| SpectraBase Compound ID | JYy5hGsKJlz |
|---|---|
| InChI | InChI=1S/C30H46O3/c1-25(2)12-14-30(18-31)15-13-28(6)19(20(30)17-25)16-21(32)24-27(5)10-9-23(33)26(3,4)22(27)8-11-29(24,28)7/h16,20,22,24,31H,8-15,17-18H2,1-7H3/t20-,22-,24+,27?,28?,29?,30+/m0/s1 |
| InChIKey | QJCHSXDOPDGBSN-MOMSNZHFSA-N |
| Mol Weight | 454.7 g/mol |
| Molecular Formula | C30H46O3 |
| Exact Mass | 454.344695 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KNmN5QmnzJi |
|---|---|
| Name | 28-HYDROXY-OLEAN-12-ENE-3,11-DIONE;KRUKOVINE_A |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H46O3 |
| InChI | InChI=1S/C30H46O3/c1-25(2)12-14-30(18-31)15-13-28(6)19(20(30)17-25)16-21(32)24-27(5)10-9-23(33)26(3,4)22(27)8-11-29(24,28)7/h16,20,22,24,31H,8-15,17-18H2,1-7H3/t20-,22-,24+,27?,28?,29?,30+/m0/s1 |
| InChIKey | QJCHSXDOPDGBSN-MOMSNZHFSA-N |
| Literature Reference Author | T.HONDA,H.J.FINLAY,G.W.GRIBBLE |
| Literature Reference Citation | J.NAT.PROD.,60,1174(1997) |
| Literature Reference DOI | 10.1021/np9702897 |
| Molecular Weight | 454.693 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ10778 |