| SpectraBase Compound ID | IdMFf36qgCJ |
|---|---|
| InChI | InChI=1S/C37H56O8/c1-22(38)43-21-34(7)28-13-14-36(9)29(33(28,6)20-27(44-23(2)39)30(34)45-24(3)40)12-11-25-26-19-32(4,5)15-17-37(26,31(41)42-10)18-16-35(25,36)8/h11,26-30H,12-21H2,1-10H3/t26?,27-,28?,29?,30+,33+,34+,35-,36-,37+/m1/s1 |
| InChIKey | DJMUBVMFYRJRMK-LRBKYPKVSA-N |
| Mol Weight | 628.8 g/mol |
| Molecular Formula | C37H56O8 |
| Exact Mass | 628.397519 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DA1E87rVPI4 |
|---|---|
| Name | 2-ALPHA,3-BETA,23-TRIACETOXY-OLEAN-12-EN-28-OIC-ACID-METHYLESTER |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C37H56O8 |
| InChI | InChI=1S/C37H56O8/c1-22(38)43-21-34(7)28-13-14-36(9)29(33(28,6)20-27(44-23(2)39)30(34)45-24(3)40)12-11-25-26-19-32(4,5)15-17-37(26,31(41)42-10)18-16-35(25,36)8/h11,26-30H,12-21H2,1-10H3/t26?,27-,28?,29?,30+,33+,34+,35-,36-,37+/m1/s1 |
| InChIKey | DJMUBVMFYRJRMK-LRBKYPKVSA-N |
| Literature Reference Author | B.DIALLO,M.VANHAELEN,R.VANHAELEN-FASTRE,T.KONOSHIMA,M.KOZUKA ,H.TOKUDA |
| Literature Reference Citation | J.NAT.PROD.,52,879(1989) |
| Literature Reference DOI | 10.1021/np50064a039 |
| Molecular Weight | 628.847 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWED18112 |