| SpectraBase Compound ID | Bdc44UJw6KY |
|---|---|
| InChI | InChI=1S/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/h19-20,22-24,32H,9-18H2,1-8H3 |
| InChIKey | JDNJALCACXLCSD-UHFFFAOYSA-N |
| Mol Weight | 470.7 g/mol |
| Molecular Formula | C31H50O3 |
| Exact Mass | 470.375995 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 1GGZs065bqx |
|---|---|
| Name | Methyl 3-hydroxyolean-18-en-28-oate |
| CAS Registry Number | 35933-00-7 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C31H50O3 |
| InChI | InChI=1S/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/h19-20,22-24,32H,9-18H2,1-8H3 |
| InChIKey | JDNJALCACXLCSD-UHFFFAOYSA-N |
| Molecular Weight | 470.738 g/mol |
| SMILES | OC1CCC2(C(C1(C)C)CCC1(C3(C(CCC21)C=1C(CC3)(CCC(C)(C)C1)C(OC)=O)C)C)C |
| SPLASH | splash10-0w29-0090000000-0cc1177f6ce60fb331a8 |
| Source of Spectrum | W5-1989-37450-28086 |
| Synonyms | 10-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-3,4,5,6,6a,7,8,8a,10,11,12,13,14,14a-tetradecahydropicene-4a-carboxylic acid methyl ester Methyl 10-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-3,4,5,6,6a,7,8,8a,10,11,12,13,14,14a-tetradecahydropicene-4a-carboxylate Methyl 2,2,6a,6b,9,9,12a-heptamethyl-10-oxidanyl-3,4,5,6,6a,7,8,8a,10,11,12,13,14,14a-tetradecahydropicene-4a-carboxylate Methyl 3.beta.-hydroxyolean-18-en-28-oate |
| Wiley ID | 1392994 |