| SpectraBase Compound ID | Eiyn5ma071u |
|---|---|
| InChI | InChI=1S/C30H44O4/c1-17(2)14-18-15-19(26(33)34-18)25-22(31)16-30(7)21-8-9-23-27(3,4)24(32)11-12-28(23,5)20(21)10-13-29(25,30)6/h8,14,18-20,22-23,25,31H,9-13,15-16H2,1-7H3/t18?,19?,20-,22-,23-,25+,28+,29-,30+/m0/s1 |
| InChIKey | ATCDAPSXPIJHOR-BXRPWOLFSA-N |
| Mol Weight | 468.7 g/mol |
| Molecular Formula | C30H44O4 |
| Exact Mass | 468.32396 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6wT4xRSrEl6 |
|---|---|
| Name | 16-BETA-HYDROXY-TIRUCALLA-7,24-(25)-DIEN-3-OXO-21,23-OLIDE |
| Compound Number | 7 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H44O4 |
| InChI | InChI=1S/C30H44O4/c1-17(2)14-18-15-19(26(33)34-18)25-22(31)16-30(7)21-8-9-23-27(3,4)24(32)11-12-28(23,5)20(21)10-13-29(25,30)6/h8,14,18-20,22-23,25,31H,9-13,15-16H2,1-7H3/t18?,19?,20-,22-,23-,25+,28+,29-,30+/m0/s1 |
| InChIKey | ATCDAPSXPIJHOR-BXRPWOLFSA-N |
| Literature Reference Author | Q.G.TAN,X.N.LI,H.CHEN,T.FENG,X.H.CAI,X.D.LUO |
| Literature Reference Citation | J.NAT.PROD.,73,693(2010) |
| Literature Reference DOI | 10.1021/np1000472 |
| Molecular Weight | 468.677 g/mol |
| Sample ID | 35347 |
| Solvent | CDCl3 |