| SpectraBase Compound ID | H59hgDTatOJ |
|---|---|
| InChI | InChI=1S/C30H48O3/c1-18-10-15-30(25(32)33)17-16-28(6)20(24(30)19(18)2)8-9-22-27(5)13-12-23(31)26(3,4)21(27)11-14-29(22,28)7/h10,19-24,31H,8-9,11-17H2,1-7H3,(H,32,33)/t19-,20-,21+,22-,23+,24-,27+,28-,29-,30+/m1/s1 |
| InChIKey | HNJKFVJZKCXLRL-SILQXMKOSA-N |
| Mol Weight | 456.7 g/mol |
| Molecular Formula | C30H48O3 |
| Exact Mass | 456.360345 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | J9GgMTXTAL7 |
|---|---|
| Name | 3-BETA-HYDROXY-18-ALPHA,19-ALPHA-URS-20-EN-28-OIC-ACID |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H48O3 |
| InChI | InChI=1S/C30H48O3/c1-18-10-15-30(25(32)33)17-16-28(6)20(24(30)19(18)2)8-9-22-27(5)13-12-23(31)26(3,4)21(27)11-14-29(22,28)7/h10,19-24,31H,8-9,11-17H2,1-7H3,(H,32,33)/t19-,20-,21+,22-,23+,24-,27+,28-,29-,30+/m1/s1 |
| InChIKey | HNJKFVJZKCXLRL-SILQXMKOSA-N |
| Literature Reference Author | T.LOBO-ECHEVERRI,J.F.RIVERO-CRUZ,B.N.SU,H.B.CHAI,G.A.CORDELL ,J.M.PEZZUTO,S.M.SWA |
| Literature Reference Citation | J.NAT.PROD.,68,577(2005) |
| Literature Reference DOI | 10.1021/np0496688 |
| Molecular Weight | 456.709 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMZ9639 |