(16β,20S)-15-Deoxy-...

(16β,20S)-15-Deoxy-16,17-dihydro-15-oxoveatchine(CAS No. 545-60-8)

(16β,20S)-15-Deoxy-16,17-dihydro-15-oxoveatchine(CAS No. 545-60-8)

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Keywords

5H,13cH-8a,11-Methano-6,13b-propanocyclohept[ h]oxazolo[2,3-a]isoquinolin-9(10H)-one,decahydro-6,10- 545-60-8 98%

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  • Appearance:Solid
  • Application:Organic Chemicals
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Details:

【Name】
(16β,20S)-15-Deoxy-16,17-dihydro-15-oxoveatchine
【CAS Registry number】
545-60-8
【Synonyms】
(16β,20S)-15-Deoxy-16,17-dihydro-15-oxoveatchine
Cuauchichicine
【Molecular Formula】
C22H33NO2 (Products with the same molecular formula)
【Molecular Weight】
0
【Inchi】
InChI=1/C22H33NO2/c1-14-15-4-5-17-21(12-15,18(14)24)9-6-16-20(2)7-3-8-22(16,17)19-23(13-20)10-11-25-19/h14-17,19H,3-13H2,1-2H3/t14-,15,16-,17-,19+,20+,21-,22+/m1/s1
【Canonical SMILES】
CC1C2CCC3C(C2)(C1=O)CCC4C35CCCC4(CN6C5OCC6)C
Chemical and Physical Properties
【Density】
1.18g/cm3
【Boiling Point】
473.5°C at 760 mmHg
【Refractive Index】
1.583
【Flash Point】
240.2°C
【Computed Properties】
Molecular Weight:343.50292 [g/mol]
Molecular Formula:C22H33NO2
XLogP3-AA:4.2
H-Bond Donor:0
H-Bond Acceptor:3
Rotatable Bond Count:0
Tautomer Count:2
Exact Mass:343.251129
MonoIsotopic Mass:343.251129
Topological Polar Surface Area:29.5
Heavy Atom Count:25
Formal Charge:0
Complexity:634
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:8
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1

 

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