| 2D Structure | |
| CID | 612822 |
| Target | / |
| IUPAC Name | methyl 4,6a,6b,8a,11,12,14b-heptamethyl-3-oxo-1,2,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydropicene-4-carboxylate |
| InChI | InChI=1S/C31H48O3/c1-19-11-14-27(3)17-18-29(5)21(25(27)20(19)2)9-10-22-28(4)15-13-24(32)31(7,26(33)34-8)23(28)12-16-30(22,29)6/h9,19-20,22-23,25H,10-18H2,1-8H3 |
| InChI Key | DWWPSRGTSZHWME-UHFFFAOYSA-N |
| Canonical SMILES | CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(=O)C5(C)C(=O)OC)C)C)C2C1C)C)C |
| Isomeric SMILES | CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(=O)C5(C)C(=O)OC)C)C)C2C1C)C)C |
| Molecular Formula | C31H48O3 |
| Molecular Weight | 468.7 |
| synonyms | ['Urs-12-en-24-oic acid, 3-oxo-, methyl ester', 'DWWPSRGTSZHWME-UHFFFAOYSA-N', 'Methyl 3-oxours-12-en-23-oate #', 'Urs-12-en-24-oic acid, 3-oxo-, methyl ester, (+)-'] |
From Pubchem