| SpectraBase Compound ID | ByxCx5FTATf |
|---|---|
| InChI | InChI=1S/C30H48O7/c1-16-9-12-30(24(35)36)14-13-26(3)17(21(30)29(16,6)37)7-8-19-27(26,4)11-10-18-25(2,15-31)22(33)20(32)23(34)28(18,19)5/h7,16,18-23,31-34,37H,8-15H2,1-6H3,(H,35,36)/t16-,18+,19+,20+,21-,22+,23+,25+,26-,27-,28+,29-,30+/m1/s1 |
| InChIKey | URUKJKAHSHXWOF-QVPHHARSSA-N |
| Mol Weight | 520.7 g/mol |
| Molecular Formula | C30H48O7 |
| Exact Mass | 520.340004 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HU6XN7pgHhz |
|---|---|
| Name | GAMBOUKOKOENSEIN-A;1-ALPHA,2-ALPHA,3-BETA,19-ALPHA,23-PENTAHYDROXYURS-12-EN-28-OIC-ACID |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H48O7 |
| InChI | InChI=1S/C30H48O7/c1-16-9-12-30(24(35)36)14-13-26(3)17(21(30)29(16,6)37)7-8-19-27(26,4)11-10-18-25(2,15-31)22(33)20(32)23(34)28(18,19)5/h7,16,18-23,31-34,37H,8-15H2,1-6H3,(H,35,36)/t16-,18+,19+,20+,21-,22+,23+,25+,26-,27-,28+,29-,30+/m1/s1 |
| InChIKey | URUKJKAHSHXWOF-QVPHHARSSA-N |
| Literature Reference Author | J.WANDJI,F.TILLEQUIN,D.A.MULHOLLAND,J.C.SHIRRI,N.TSABANG,E.S EGUIN,P.VERITE,F.LIB |
| Literature Reference Citation | PHYTOCHEM.,64,845(2003) |
| Literature Reference DOI | 10.1016/S0031-9422(03)00495-3 |
| Molecular Weight | 520.707 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWKP5838 |