| SpectraBase Compound ID | AROMdVECP4k |
|---|---|
| InChI | InChI=1S/C29H44O5/c1-24(34)12-14-29(23(32)33)15-13-27(4)18(19(29)16-24)6-7-21-25(2)10-9-22(31)26(3,17-30)20(25)8-11-28(21,27)5/h6,17,19-22,31,34H,7-16H2,1-5H3,(H,32,33)/t19-,20?,21?,22-,24+,25-,26-,27+,28+,29-/m0/s1 |
| InChIKey | BQTIOBPQGSIVMX-CXIYBOBLSA-N |
| Mol Weight | 472.7 g/mol |
| Molecular Formula | C29H44O5 |
| Exact Mass | 472.318875 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KGcizM5N5F6 |
|---|---|
| Name | 3-BETA,20-ALPHA-DIHYDROXY-23-OXO-30-NOR-OLEAN-12-EN-28-OIC-ACID |
| Compound Number | 3A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H44O5 |
| InChI | InChI=1S/C29H44O5/c1-24(34)12-14-29(23(32)33)15-13-27(4)18(19(29)16-24)6-7-21-25(2)10-9-22(31)26(3,17-30)20(25)8-11-28(21,27)5/h6,17,19-22,31,34H,7-16H2,1-5H3,(H,32,33)/t19-,20?,21?,22-,24+,25-,26-,27+,28+,29-/m0/s1 |
| InChIKey | BQTIOBPQGSIVMX-CXIYBOBLSA-N |
| Literature Reference Author | S.Y.PARK,S.Y.CHANG,O.J.OH,C.S.YOOK,T.NOHARA |
| Literature Reference Citation | PHYTOCHEM.,59,379(2002) |
| Literature Reference DOI | 10.1016/S0031-9422(01)00436-8 |
| Molecular Weight | 472.665 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWVN2612 |