| SpectraBase Compound ID | KCvq8EcrkAd |
|---|---|
| InChI | InChI=1S/C31H50O4/c1-19-10-15-31(26(34)35-7)17-16-29(5)21(25(31)20(19)2)8-9-23-27(3)13-12-24(33)28(4,18-32)22(27)11-14-30(23,29)6/h8,19-20,22-25,32-33H,9-18H2,1-7H3/t19-,20+,22?,23?,24+,25+,27+,28-,29-,30-,31+/m1/s1 |
| InChIKey | NNDZXJBMKVWZKK-QNQMKPOVSA-N |
| Mol Weight | 486.7 g/mol |
| Molecular Formula | C31H50O4 |
| Exact Mass | 486.37091 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JJyyYWJ0GZN |
|---|---|
| Name | METHYL-3-BETA,24-DIHYDROXY-URS-12-EN-28-OATE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H50O4 |
| InChI | InChI=1S/C31H50O4/c1-19-10-15-31(26(34)35-7)17-16-29(5)21(25(31)20(19)2)8-9-23-27(3)13-12-24(33)28(4,18-32)22(27)11-14-30(23,29)6/h8,19-20,22-25,32-33H,9-18H2,1-7H3/t19-,20+,22?,23?,24+,25+,27+,28-,29-,30-,31+/m1/s1 |
| InChIKey | NNDZXJBMKVWZKK-QNQMKPOVSA-N |
| Literature Reference Author | C.Y.DUH,J.M.PEZZUTO,A.D.KINGHORN,S.L.LEUNG,N.R.FARNSWORTH |
| Literature Reference Citation | J.NAT.PROD.,50,63(1987) |
| Literature Reference DOI | 10.1021/np50049a010 |
| Molecular Weight | 486.736 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWBK291 |