-
Name
Methyl oleanolate
- EINECS 217-029-1
- CAS No. 1724-17-0
- Article Data137
- CAS DataBase
- Density 1.07g/cm3
- Solubility
- Melting Point 200-205oC
- Formula C31H50O3
- Boiling Point 526.1oCat760mmHg
- Molecular Weight 470.736
- Flash Point 190.7oC
- Transport Information
- Appearance
- Safety 22-36/37/39
- Risk Codes 36/37/38
-
Molecular Structure
- Hazard Symbols
- Synonyms Olean-12-en-28-oicacid, 3b-hydroxy-, methyl ester(6CI,7CI,8CI);Methyl 3b-hydroxyolean-12-en-28-oate;Methyl oleanolate;Oleanolic acid methylester;Virgaureagenin B methyl ester;
- PSA 46.53000
- LogP 7.32200
Methyl oleanolate Specification
The Methyl oleanolate with the cas number 1724-17-0 is also called 3β-Hydroxyolean-12-en-28-oic acid methyl ester. The IUPAC name is methyl(4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate. Its EINECS registry number is 217-029-1. This chemical belongs to the following product categories: (1)Pentacyclic triterpenes; (2)Tri-Terpenoids.
Properties Computed from Structure: (1)XLogP3-AA: 7.8; (2)H-Bond Donor: 1; (3)H-Bond Acceptor: 3; (4)Rotatable Bond Count: 2; (5)Exact Mass: 470.375995; (6)MonoIsotopic Mass: 470.375995; (7)Topological Polar Surface Area: 46.5; (8)Heavy Atom Count: 34; (9)Formal Charge: 0; (10)Complexity 900; (11)Isotope Atom Count: 0; (12)Defined Atom StereoCenter Count: 8; (13)Undefined Atom StereoCenter Count: 0; (14)Defined Bond StereoCenter Count: 0; (15)Undefined Bond StereoCenter Count: 0; (16)Covalently-Bonded Unit Count: 1.
When you are using this chemical, please be cautious about it as the following: (1)Irritating to eyes, respiratory system and skin; (2)Do not breathe dust; (3)Wear suitable protective clothing, gloves and eye/face protection.
You can still convert the following datas into molecular structure:
(1)SMILES: C=12[C@@H]3CC(C)(C)CC[C@@]3(CC[C@@]2(C)[C@@]2([C@@H]([C@@]3(CC[C@@H](C([C@@H]3CC2)(C)C)O)C)CC1)C)C(=O)OC
(2)InChI: InChI=1/C31H50O3/c1-26(2)15-17-31(25(33)34-8)18-16-29(6)20(21(31)19-26)9-10-23-28(5)13-12-24(32)27(3,4)22(28)11-14-30(23,29)7/h9,21-24,32H,10-19H2,1-8H3/t21-,22-,23+,24-,28-,29+,30+,31-/m0/s1
Related Products
- Methyl 1-Benzyl-5-oxopyrrolidine-3-carboxylate
- Methyl (((methoxymethylphosphinothioyl)thio)acetyl)methylcarbamate
- Methyl (+)-(3R)-7-[4-(4-fluorophenyl)-6-isopropyl-2-(N-methyl-N-methanesulfonylamino)pyrimidin-5-yl]-3-hydroxy-5-oxo-(6E)-heptenoate
- Methyl (2-amino-5-methyl-1,3-thiazol-4-yl)acetate
- Methyl (2-chloromethyl)oxazole-4-carboxylate
- Methyl (2E)-3-(4-methylphenyl)propenoate
- Methyl (2E)-3-cyclohexylprop-2-enoate
- Methyl (2R)-2-[(tert-butoxycarbonyl)amino]-3-iodopropanoate
- Methyl (2R)-2-[4-(2,4-dichlorophenoxy)phenoxy]propanoate
- Methyl (2R)-2-amino-2-cyclohexylethanoate hydrochloride
- 172418-32-5
- 172422-02-5
- 172422-76-3
- 172424-98-5
- 172426-86-7
- 17243-13-9
- 17243-14-0
- 1724-39-6
- 172451-37-5
- 17245-25-9
Hot Products
About|Contact|Cas|Product Name|Molecular|Country|Encyclopedia
Message|New Cas|MSDS|Service|Advertisement|CAS DataBase|Article Data|Manufacturers | Chemical Catalog
©2008 LookChem.com,License: ICP
NO.:Zhejiang16009103
complaints:service@lookchem.com Desktop View