| SpectraBase Compound ID | IKXftIzsYXk |
|---|---|
| InChI | InChI=1S/C30H50O2/c1-25(2)14-16-30(19-31)17-15-28(6)20(21(30)18-25)8-9-23-27(5)12-11-24(32)26(3,4)22(27)10-13-29(23,28)7/h8,21-24,31-32H,9-19H2,1-7H3/t21?,22?,23?,24-,27-,28+,29+,30+/m0/s1 |
| InChIKey | PSZDOEIIIJFCFE-QXSRUYARSA-N |
| Mol Weight | 442.7 g/mol |
| Molecular Formula | C30H50O2 |
| Exact Mass | 442.381081 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 1Dqg05f4wUv |
|---|---|
| Name | (3beta)-olean-12-ene-3,28-diol |
| Alternate Name(s) | (3S,6aR,6bS,8aS,14bR)-4,4,6a,6b,11,11,14b-heptamethyl-8a-methylol-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-ol (3.beta.)-olean-12-ene-3,28-diol (3S,6aR,6bS,8aS,14bR)-8a-(hydroxymethyl)-4,4,6a,6b,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-ol (3S,6aR,6bS,8aS,14bR)-8a-(hydroxymethyl)-4,4,6a,6b,11,11,14b-heptamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-icosahydropicen-3-ol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C30H50O2 |
| InChI | InChI=1S/C30H50O2/c1-25(2)14-16-30(19-31)17-15-28(6)20(21(30)18-25)8-9-23-27(5)12-11-24(32)26(3,4)22(27)10-13-29(23,28)7/h8,21-24,31-32H,9-19H2,1-7H3/t21?,22?,23?,24-,27-,28+,29+,30+/m0/s1 |
| InChIKey | PSZDOEIIIJFCFE-QXSRUYARSA-N |
| Molecular Weight | 442.728 g/mol |
| SMILES | OC[C@@]12CCC(CC2C=2[C@]([C@@]3(CCC4C([C@](CC[C@@]4(C3CC2)C)(O)[H])(C)C)C)(CC1)C)(C)C |
| SPLASH | splash10-0udi-9460000000-d54ce762424cd92628be |
| Source of Spectrum | EMC-2014-325-8 |
| Wiley ID | 1740231 |