7-Hydroxy cholesterol supplier

Name
7BETA-HYDROXYCHOLESTEROL
EINECS
CAS No. 566-27-8
Article Data41
CAS DataBase
Density 1.03 g/cm³
Solubility
Melting Point 165-167?C
Formula C₂₇H₄₆O₂
Boiling Point 515.3 ºC at 760 mmHg
Molecular Weight 402.661
Flash Point 214.7 ºC
Transport Information
Appearance
Safety 22-26
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Cholest-5-ene-3b,7b-diol (8CI);7b-Hydroxycholest-5-en-3b-ol;7b-Hydroxycholesterol;D5-Cholestene-3b,7b-diol;
PSA 40.46000
LogP 6.35950

Synthetic route

: 17974-80-0
3β,7β-cholest-5-ene-3,7-diol-3-benzoate

: 566-27-8
cholest-5-en-3β,7β-diol

Conditions

Conditions	Yield
With sodium carbonate In methanol; water for 0.5h; Heating;	100%
With sodium hydroxide; tetrabutylammomium bromide In tetrahydrofuran for 48h; Heating;	90 mg

: 17974-77-5
3β-acetoxy-7β-hydroxycholest-5-ene

: 566-27-8
cholest-5-en-3β,7β-diol

Conditions

Conditions	Yield
With water; sodium hydroxide In ethanol; dichloromethane at 20℃; for 2h;	95%
With sodium carbonate In methanol; water at 25℃; Inert atmosphere;

: 18099-24-6
cholest-5-ene-3β,7β-diol diacetate

: 566-27-8
cholest-5-en-3β,7β-diol

Conditions

Conditions	Yield
With sodium hydroxide In methanol at 20℃; Deacetylation;	87%

: 809-51-8
7-ketocholesteryl acetate

A: 566-26-7
(3S,7S,8S,9S,10R,13R,14S,17R)-17-((R)-1,5-Dimethyl-hexyl)-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol

B: 566-27-8
cholest-5-en-3β,7β-diol

Conditions

Conditions	Yield
With lithium aluminium tetrahydride In tetrahydrofuran at 65℃; for 2h;	A 80% B n/a
With aluminum isopropoxide; isopropyl alcohol Behandeln der Reaktionsloesung mit wss. KOH bei Raumtemperatur;
With lithium aluminium tetrahydride

: 566-28-9
7-Oxocholesterol

: 566-27-8
cholest-5-en-3β,7β-diol

Conditions

Conditions	Yield
With sodium tetrahydroborate In tetrahydrofuran; methanol at 20℃; for 2h;	79%
With sodium tetrahydroborate; cerium(III) chloride In tetrahydrofuran; methanol for 0.166667h; Ambient temperature;	78%
With sodium tetrahydroborate; cerium(III) chloride In tetrahydrofuran; methanol at 20℃; for 1h;	75%
With sodium tetrahydroborate; cerium(III) chloride heptahydrate In methanol at 0 - 20℃; for 4h; Inert atmosphere;	58%
Multi-step reaction with 3 steps 1: Et3N / CH2Cl2 / 0 °C 2: 1) 1M L-Selectride, 2) 6 M aq. NaOH, 30percent H2O2 / 1) THF, -78 deg C, 5 h, 2) THF, H2O, r.t., 1 h 3: 90 mg / nBu4NBr, 0.5 M aq. NaOH / tetrahydrofuran / 48 h / Heating View Scheme

: 57-88-5
cholesterol

A: 566-28-9
7-Oxocholesterol

B: 566-27-8
cholest-5-en-3β,7β-diol

Conditions

Conditions	Yield
With tert.-butylhydroperoxide; tetra-(n-butyl)ammonium iodide In dichloromethane at 23℃; for 48h; Catalytic behavior; Time; Temperature; chemoselective reaction;	A 53% B 15%

: 75-91-2
tert.-butylhydroperoxide

: 57-88-5
cholesterol

A: 566-28-9
7-Oxocholesterol

B: 36871-91-7, 75671-16-8, 75671-17-9, 86900-29-0, 2846-29-9
3β-hydroxycholest-5-ene-7α-hydroperoxide

C: 566-26-7
(3S,7S,8S,9S,10R,13R,14S,17R)-17-((R)-1,5-Dimethyl-hexyl)-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol

D: 566-27-8
cholest-5-en-3β,7β-diol

E: 36871-91-7
7β-hydroperoxy-3β-hydroxycholest-5-ene

Conditions

Conditions	Yield
Rh2(cap)4 In dichloromethane at 25℃; for 15h; Allylic oxidation;	A 30% B 10% C 12% D 3% E 4%

...Expand

: 57-88-5
cholesterol

A: 566-28-9
7-Oxocholesterol

B: 36871-91-7, 75671-16-8, 75671-17-9, 86900-29-0, 2846-29-9
3β-hydroxycholest-5-ene-7α-hydroperoxide

C: 566-26-7
(3S,7S,8S,9S,10R,13R,14S,17R)-17-((R)-1,5-Dimethyl-hexyl)-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol

D: 566-27-8
cholest-5-en-3β,7β-diol

E: 36871-91-7
7β-hydroperoxy-3β-hydroxycholest-5-ene

Conditions

Conditions	Yield
With tert.-butylhydroperoxide; [Rh2(cap)4*2CH3CN] In water; 1,2-dichloro-ethane at 25℃; for 15h;	A 30% B 10% C 12% D 3% E 4%

...Expand

: 57-88-5
cholesterol

A: 566-28-9
7-Oxocholesterol

B: 566-27-8
cholest-5-en-3β,7β-diol

C: 2953-38-0, 4025-59-6, 24116-45-8, 55700-78-2, 75764-48-6, 97100-48-6, 114246-94-5, 134356-45-9, 1250-95-9
5beta,6beta-Epoxycholestanol

D: 1250-95-9
5α,6α-epoxycholestan-3β-ol

Conditions

Conditions	Yield
at 150℃; Further byproducts given;	A 21.9% B 13% C 7.4% D 10.8%
at 150℃; Further byproducts given;	A 21.9% B 13% C 7.4% D 10.8%
at 150℃; for 1h;

...Expand

: 57-88-5
cholesterol

A: 566-28-9
7-Oxocholesterol

B: 2140-46-7
25-hydroxychlolesterol

C: 566-27-8
cholest-5-en-3β,7β-diol

D: 1250-95-9
5α,6α-epoxycholestan-3β-ol

Conditions

Conditions	Yield
at 150℃; Further byproducts given;	A 21.9% B 2.3% C 13% D 10.8%

...Expand

: 57-88-5
cholesterol

A: 566-28-9
7-Oxocholesterol

B: 566-26-7
(3S,7S,8S,9S,10R,13R,14S,17R)-17-((R)-1,5-Dimethyl-hexyl)-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol

C: 566-27-8
cholest-5-en-3β,7β-diol

D: 1250-95-9
5α,6α-epoxycholestan-3β-ol

Conditions

Conditions	Yield
at 150℃; Further byproducts given;	A 21.9% B 4% C 13% D 10.8%

...Expand

: 57-88-5
cholesterol

A: 566-28-9
7-Oxocholesterol

B: 566-27-8
cholest-5-en-3β,7β-diol

C: 17954-98-2
22(R)-Hydroxycholesterol

D: 1250-95-9
5α,6α-epoxycholestan-3β-ol

Conditions

Conditions	Yield
at 150℃; Further byproducts given;	A 21.9% B 13% C 0.6% D 10.8%

...Expand

: 57-88-5
cholesterol

A: 566-28-9
7-Oxocholesterol

B: 566-27-8
cholest-5-en-3β,7β-diol

C: 17711-16-9, 17954-98-2, 22348-64-7, 59532-44-4, 59532-45-5
22-(S)-hydroxycholesterol

D: 1250-95-9
5α,6α-epoxycholestan-3β-ol

Conditions

Conditions	Yield
at 150℃; Further byproducts given;	A 21.9% B 13% C 0.3% D 10.8%

...Expand

: 57-88-5
cholesterol

: 566-27-8
cholest-5-en-3β,7β-diol

: 809-51-8
7-ketocholesteryl acetate

: 555-31-7
aluminum isopropoxide

: 67-63-0
isopropyl alcohol

A: 566-26-7
(3S,7S,8S,9S,10R,13R,14S,17R)-17-((R)-1,5-Dimethyl-hexyl)-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol

B: 566-27-8
cholest-5-en-3β,7β-diol

Conditions

Conditions	Yield
anschliessenden Behandeln mit wss.KOH;
anschliessenden Behandeln mit wss.KOH;

...Expand

: 57-88-5
cholesterol

A: 566-28-9
7-Oxocholesterol

B: 1253-84-5
cholestanetriol

C: 566-26-7
(3S,7S,8S,9S,10R,13R,14S,17R)-17-((R)-1,5-Dimethyl-hexyl)-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol

D: 566-27-8
cholest-5-en-3β,7β-diol

E: 86900-29-0
3β-hydroxycholest-5-ene-7-hydroperoxide

F: 55700-78-2
(6aS,6bS,9R,9aR,11aS,11bR)-9a,11b-dimethyl-9-((R)-6-methylheptan-2-yl)hexadecahydrocyclopenta[1,2]phenanthro[8a,9-b]oxiren-3-ol

Conditions

Conditions	Yield
With egg lechitin; oxygen; tris(acetylacetonato)iron(III) In benzene at 40℃; for 24h; Product distribution; determination of fatty acid degradation, determination of stereoselectivity of epoxidation, inhibition of a radical scavenger in the oxidation, other temperature, other solvent, other catalyst;

...Expand

: 57-88-5
cholesterol

A: 566-28-9
7-Oxocholesterol

B: 1253-84-5
cholestanetriol

C: 566-26-7
(3S,7S,8S,9S,10R,13R,14S,17R)-17-((R)-1,5-Dimethyl-hexyl)-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol

D: 566-27-8
cholest-5-en-3β,7β-diol

E: 2953-38-0, 4025-59-6, 24116-45-8, 55700-78-2, 75764-48-6, 97100-48-6, 114246-94-5, 134356-45-9, 1250-95-9
5beta,6beta-Epoxycholestanol

F: 1250-95-9
5α,6α-epoxycholestan-3β-ol

Conditions

Conditions	Yield
With air at 150℃; for 24h; Product distribution; var. temperature, var. time;

...Expand

: 57-88-5
cholesterol

A: 601-54-7
Cholest-5-en-3-one

B: 601-57-0
Cholest-4-en-3-one

C: 566-26-7
(3S,7S,8S,9S,10R,13R,14S,17R)-17-((R)-1,5-Dimethyl-hexyl)-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol

D: 566-27-8
cholest-5-en-3β,7β-diol

E: 2953-38-0, 4025-59-6, 24116-45-8, 55700-78-2, 75764-48-6, 97100-48-6, 114246-94-5, 134356-45-9, 1250-95-9
5beta,6beta-Epoxycholestanol

F: 1250-95-9
5α,6α-epoxycholestan-3β-ol

Conditions

Conditions	Yield
With tetrasodium 5,10,15,20-tetra(4-sulfophenyl)porphyrinatoiron(III); dihydrogen peroxide In 2,2,4-trimethylpentane; water for 12h; Product distribution; other sterols, other iron(III) porphyrins; var. water/surfactant ratio and pH; oxidation in AOT reversed micelles;

...Expand

: 604-35-3
Cholesteryl acetate

A: 566-26-7
(3S,7S,8S,9S,10R,13R,14S,17R)-17-((R)-1,5-Dimethyl-hexyl)-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol

B: 566-27-8
cholest-5-en-3β,7β-diol

Conditions

Conditions	Yield
With tert.-butylhydroperoxide; lithium aluminium tetrahydride; potassium carbonate; chromium(0) hexacarbonyl Yield given. Multistep reaction. Yields of byproduct given;

: 129238-78-4
5α-hydroperoxy-3β-benzoyloxycholest-6-ene

A: 566-26-7
(3S,7S,8S,9S,10R,13R,14S,17R)-17-((R)-1,5-Dimethyl-hexyl)-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol

B: 566-27-8
cholest-5-en-3β,7β-diol

Conditions

Conditions	Yield
With potassium hydroxide; tributyltin methoxide; triphenylphosphine Multistep reaction;

: 36871-91-7
7β-hydroperoxy-3β-hydroxycholest-5-ene

: 566-27-8
cholest-5-en-3β,7β-diol

Conditions

Conditions	Yield
With triphenylphosphine In diethyl ether Ambient temperature;

: 86900-29-0
3β-hydroxycholest-5-ene-7-hydroperoxide

A: 566-26-7
(3S,7S,8S,9S,10R,13R,14S,17R)-17-((R)-1,5-Dimethyl-hexyl)-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol

B: 566-27-8
cholest-5-en-3β,7β-diol

Conditions

Conditions	Yield
With sodium tetrahydroborate In methanol; diethyl ether Reduction;	A n/a B 40 mg

: 57-88-5
cholesterol

: 7732-18-5
water

air: air

sodium-stearate: sodium-stearate

A: 567-72-6
cholest-3,5-dien-7-one

B: 566-26-7
(3S,7S,8S,9S,10R,13R,14S,17R)-17-((R)-1,5-Dimethyl-hexyl)-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol

C: 566-27-8
cholest-5-en-3β,7β-diol

D 3β-hydroxy-cholesten-(5)-one-(7): 3β-hydroxy-cholesten-(5)-one-(7)

Conditions

Conditions	Yield
at 85℃; pH 8.5;

...Expand

: 57-88-5
cholesterol

: 7732-18-5
water

oxygen: oxygen

sodium-stearate: sodium-stearate

A: 567-72-6
cholest-3,5-dien-7-one

B: 566-26-7
(3S,7S,8S,9S,10R,13R,14S,17R)-17-((R)-1,5-Dimethyl-hexyl)-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol

C: 566-27-8
cholest-5-en-3β,7β-diol

D 3β-hydroxy-cholesten-(5)-one-(7): 3β-hydroxy-cholesten-(5)-one-(7)

Conditions

Conditions	Yield
at 85℃; pH 8.5;

...Expand

: 60-29-7
diethyl ether

: 809-51-8
7-ketocholesteryl acetate

LiAlH4: LiAlH4

A: 566-26-7
(3S,7S,8S,9S,10R,13R,14S,17R)-17-((R)-1,5-Dimethyl-hexyl)-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol

B: 566-27-8
cholest-5-en-3β,7β-diol

...Expand

: 57-88-5
cholesterol

A: 34310-88-8
3β,5α-dihydroxycholest-5-ene

B: 566-26-7
(3S,7S,8S,9S,10R,13R,14S,17R)-17-((R)-1,5-Dimethyl-hexyl)-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol

C: 566-27-8
cholest-5-en-3β,7β-diol

Conditions

Conditions	Yield
With lumiflavin; oxygen In acetonitrile for 4h; Product distribution; Further Variations:; Solvents; Reagents; reaction times; Irradiation;	A 12 mg B n/a C n/a

...Expand

: 57-88-5
cholesterol

ibu-guanosine: ibu-guanosine

: 566-27-8
cholest-5-en-3β,7β-diol

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: 62 percent / O2; N-hydroxyphthalamide; benzoyl peroxide / ethyl acetate; acetone / 72 h / 50 - 60 °C 2: 75 percent / CeCl3*H2O; NaBH4 / tetrahydrofuran; methanol / 1 h / 20 °C View Scheme

: 57-88-5
cholesterol

: 566-27-8
cholest-5-en-3β,7β-diol

Conditions

Conditions	Yield
Multi-step reaction with 3 steps 1: O2; hematoporphyrin / pyridine / 5 h / 10 °C / Irradiation 2: CHCl3 / 120 h / 20 °C 3: 40 mg / NaBH4 / methanol; diethyl ether View Scheme
Multi-step reaction with 4 steps 1: pyridine / dichloromethane / Inert atmosphere 2: pyridinium chlorochromate / toluene / Inert atmosphere 3: cerium(III) chloride heptahydrate; sodium tetrahydroborate / methanol; tetrahydrofuran / 25 °C / Inert atmosphere 4: sodium carbonate / methanol; water / 25 °C / Inert atmosphere View Scheme
Multi-step reaction with 3 steps 1: pyridine / 37 °C / Inert atmosphere 2: lithium hydroxide / tetrahydrofuran; methanol; water / 2 h / 20 °C 3: cerium(III) chloride heptahydrate; sodium tetrahydroborate / methanol / 4 h / 0 - 20 °C / Inert atmosphere View Scheme

: 55529-60-7, 3328-25-4
cholesterol 5α-hydroperoxide

: 566-27-8
cholest-5-en-3β,7β-diol

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: CHCl3 / 120 h / 20 °C 2: 40 mg / NaBH4 / methanol; diethyl ether View Scheme

: 809-51-8
7-ketocholesteryl acetate

: 566-27-8
cholest-5-en-3β,7β-diol

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1.1: LiALH4 / diethyl ether / 20 °C 1.2: 61 percent / pyridine / 1 h / 100 °C 2.1: 87 percent / NaOH / methanol / 20 °C View Scheme
Multi-step reaction with 2 steps 1: methanol; potassium carbonate / tetrahydrofuran / 1 h / 20 °C 2: sodium tetrahydroborate / methanol; tetrahydrofuran / 2 h / 20 °C View Scheme
Multi-step reaction with 2 steps 1: cerium(III) chloride heptahydrate; sodium tetrahydroborate / methanol; tetrahydrofuran / 25 °C / Inert atmosphere 2: sodium carbonate / methanol; water / 25 °C / Inert atmosphere View Scheme
Multi-step reaction with 2 steps 1: lithium hydroxide / tetrahydrofuran; methanol; water / 2 h / 20 °C 2: cerium(III) chloride heptahydrate; sodium tetrahydroborate / methanol / 4 h / 0 - 20 °C / Inert atmosphere View Scheme

: 566-27-8
cholest-5-en-3β,7β-diol

: Benzoyltriazole

: 6038-38-6
3β,7β-bis-benzoyloxy-cholest-5-ene

Conditions

Conditions	Yield
With 1,8-diazabicyclo[5.4.0]undec-7-ene In acetonitrile for 4h; Ambient temperature;	95%

: 566-27-8
cholest-5-en-3β,7β-diol

: 566-28-9
7-Oxocholesterol

Conditions

Conditions	Yield
With 3,5-dimethyl-1H-pyrazole; pyridinium chlorochromate In dichloromethane at 2 - 3℃; for 0.5h;	89%

: 566-27-8
cholest-5-en-3β,7β-diol

: 25876-54-4
Δ4-7β-hydroxycholesterol

Conditions

Conditions	Yield
With phosphate buffer pH 7; oxygen; (2-hydroxypropyl)-α-cyclodextrin at 20℃; for 24h; catalase, Brevibacterium sp. cholesterol oxidase E.C. 1.1.3.6;	85%
With catalase; cholesterol oxidase 1.) butyl acetate, 48 h; 2.) ethanol, oxalic acid, 30 min, 60 deg C; Yield given. Multistep reaction;
With buffer containing Triton-X 100; cetyltrimethylammonim bromide; cholesterol oxidase In cyclohexane; butan-1-ol Kinetics; further reaction conditions;
With recombinant Brevibacterium cholesterol oxidase In phosphate buffer; isopropyl alcohol at 25℃; for 12h; pH=7;

: 108-30-5
succinic acid anhydride

: 566-27-8
cholest-5-en-3β,7β-diol

: 95615-70-6
cholest-5-ene-3β-7β-diyl dihemisuccinate

Conditions

Conditions	Yield
With N-ethyl-N,N-diisopropylamine In dichloromethane for 24h; Inert atmosphere; Reflux;	83%

: 566-27-8
cholest-5-en-3β,7β-diol

: 202416-16-8
5α-cholestane-3β,6α,7β-triol

Conditions

Conditions	Yield
With sodium perborate tetrahydrate In tetrahydrofuran at 20℃; Inert atmosphere;	69%

: 2596-47-6, 147677-05-2, 34749-55-8
(E)-3-(4-acetoxy-3-methoxyphenyl)acrylic acid

: 566-27-8
cholest-5-en-3β,7β-diol

: 3-O-(4-acetoxyferuloyl)-7β-hydroxycholesterol

Conditions

Conditions	Yield
With dmap; dicyclohexyl-carbodiimide In dichloromethane at 0 - 20℃; for 6h; Inert atmosphere;	42%

: 110-86-1
pyridine

: 566-27-8
cholest-5-en-3β,7β-diol

: 108-24-7
acetic anhydride

: 17974-77-5
3β-acetoxy-7β-hydroxycholest-5-ene

Conditions

Conditions	Yield
at 0℃;

...Expand

: 566-27-8
cholest-5-en-3β,7β-diol

: 434-16-2
7-dehydrocholesterol

: 566-27-8
cholest-5-en-3β,7β-diol

: 144-62-7
oxalic acid

: 434-16-2
7-dehydrocholesterol

Conditions

Conditions	Yield
at 180 - 190℃;

: 566-27-8
cholest-5-en-3β,7β-diol

: 108-24-7
acetic anhydride

: 17974-77-5
3β-acetoxy-7β-hydroxycholest-5-ene

Conditions

Conditions	Yield
With pyridine at 0℃;

: 566-27-8
cholest-5-en-3β,7β-diol

: 108-24-7
acetic anhydride

: 18099-24-6
cholest-5-ene-3β,7β-diol diacetate

Conditions

Conditions	Yield
With pyridine
With pyridine

: 566-27-8
cholest-5-en-3β,7β-diol

: 98-88-4
benzoyl chloride

: 6038-38-6
3β,7β-bis-benzoyloxy-cholest-5-ene

Conditions

Conditions	Yield
With pyridine

: 566-27-8
cholest-5-en-3β,7β-diol

: 93-97-0
benzoic acid anhydride

: 434-16-2
7-dehydrocholesterol

Conditions

Conditions	Yield
at 180 - 190℃;

: 566-27-8
cholest-5-en-3β,7β-diol

: 93-97-0
benzoic acid anhydride

: 17974-80-0
3β,7β-cholest-5-ene-3,7-diol-3-benzoate

Conditions

Conditions	Yield
With benzene
With toluene
With xylene

7-Hydroxy cholesterol Specification

The IUPAC name of 7-Hydroxy cholesterol is (7R,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol. With the CAS registry number 566-27-8, it is also named as Cholest-5-ene-3,7-diol, (3beta,7beta)-. The product's categories are hydroxycholesterol, intermediates & fine chemicals, pharmaceuticals and steroids. In addition, its molecular formula is C₂₇H₄₆O₂ and molecular weight is 402.65. Moreover, this chemical is used as a metabolite of Cholesterol.

The other characteristics of this product can be summarized as: (1)ACD/LogP: 7.94; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 7.94; (4)ACD/LogD (pH 7.4): 7.94; (5)ACD/BCF (pH 5.5): 634835.13; (6)ACD/BCF (pH 7.4): 634835.13; (7)ACD/KOC (pH 5.5): 495581.5; (8)ACD/KOC (pH 7.4): 495581.5; (9)H bond acceptors: 2; (10)H bond donors: 2; (11)Freely Rotating Bonds: 7; (12)Polar Surface Area: 18.46 Å²; (13)Index of Refraction: 1.536; (14)Molar Refractivity: 121.48 cm³; (15)Molar Volume: 389.3 cm³; (16)Polarizability: 48.16×10^-24cm³; (17)Surface Tension: 41.4 dyne/cm; (18)Density: 1.03 g/cm³; (19)Flash Point: 214.7 °C; (20)Enthalpy of Vaporization: 90.6 kJ/mol; (21)Boiling Point: 515.3 °C at 760 mmHg; (22)Vapour Pressure: 8.93E-13 mmHg at 25 °C.

When you are using this chemical, please be cautious about it as the following: 7-Hydroxy cholesterol is harmful if swallowed and very toxic by inhalation.

People can use the following data to convert to the molecule structure.
SMILES:CC(C)CCC[C@@H](C)[C@H]3CC[C@H]2[C@@H]4[C@@H](O)/C=C1/C[C@@H](O)CC[C@]1(C)[C@H]4CC[C@@]23C
InChI:InChI=1/C27H46O2/c1-17(2)7-6-8-18(3)21-9-10-22-25-23(12-14-27(21,22)5)26(4)13-11-20(28)15-19(26)16-24(25)29/h16-18,20-25,28-29H,6-15H2,1-5H3/t18-,20+,21-,22+,23+,24+,25+,26+,27-/m1/s1
InChIKey:OYXZMSRRJOYLLO-KGZHIOMZBE
Std. InChI:InChI=1S/C27H46O2/c1-17(2)7-6-8-18(3)21-9-10-22-25-23(12-14-27(21,22)5)26(4)13-11-20(28)15-19(26)16-24(25)29/h16-18,20-25,28-29H,6-15H2,1-5H3/t18-,20+,21-,22+,23+,24+,25+,26+,27-/m1/s1
Std. InChIKey:OYXZMSRRJOYLLO-KGZHIOMZSA-N

Product Name

7BETA-HYDROXYCHOLESTEROL

Synthetic route

7-Hydroxy cholesterol Specification

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