| SpectraBase Compound ID | DxFwC3AD1B0 |
|---|---|
| InChI | InChI=1S/C30H46O5/c1-25(2)20-9-12-29(6)21(28(20,5)11-10-22(25)31)8-7-18-19-17-27(4,23(32)33)14-13-26(19,3)15-16-30(18,29)24(34)35/h7,19-22,31H,8-17H2,1-6H3,(H,32,33)(H,34,35)/t19-,20?,21+,22?,26-,27?,28?,29+,30-/m1/s1 |
| InChIKey | QEZXREBSGZAJJO-HRSYEKRWSA-N |
| Mol Weight | 486.7 g/mol |
| Molecular Formula | C30H46O5 |
| Exact Mass | 486.334525 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Jn5fkNwCCKo |
|---|---|
| Name | 3.alpha.-Hydroxyolean-12-ene-27,29-dioic-acid |
| CAS Registry Number | 86727-53-9 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C30H46O5 |
| InChI | InChI=1S/C30H46O5/c1-25(2)20-9-12-29(6)21(28(20,5)11-10-22(25)31)8-7-18-19-17-27(4,23(32)33)14-13-26(19,3)15-16-30(18,29)24(34)35/h7,19-22,31H,8-17H2,1-6H3,(H,32,33)(H,34,35)/t19-,20?,21+,22?,26-,27?,28?,29+,30-/m1/s1 |
| InChIKey | QEZXREBSGZAJJO-HRSYEKRWSA-N |
| Literature Reference | J. Org. Chem. 48, 3525 (1983). |
| NMR Standard | not reported |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |