| SpectraBase Compound ID | 3XZCBCZQVnh |
|---|---|
| InChI | InChI=1S/C27H46O4/c1-23(2)19-9-14-25(4)20(24(19,3)12-10-21(23)30)16-18(29)22-17(8-13-26(22,25)5)27(6,31)11-7-15-28/h17,19-22,28,30-31H,7-16H2,1-6H3/t17-,19?,20?,21-,22-,24-,25+,26+,27+/m0/s1 |
| InChIKey | NWJGLJHDVMUIMJ-NPOAOIOLSA-N |
| Mol Weight | 434.7 g/mol |
| Molecular Formula | C27H46O4 |
| Exact Mass | 434.33961 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4DUNMhOsndk |
|---|---|
| Name | 3-BETA,20-R,24-TRIHYDROXY-PROPAKISNORDAMMARAN-12-ONE |
| Compound Number | 12 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H46O4 |
| InChI | InChI=1S/C27H46O4/c1-23(2)19-9-14-25(4)20(24(19,3)12-10-21(23)30)16-18(29)22-17(8-13-26(22,25)5)27(6,31)11-7-15-28/h17,19-22,28,30-31H,7-16H2,1-6H3/t17-,19?,20?,21-,22-,24-,25+,26+,27+/m0/s1 |
| InChIKey | NWJGLJHDVMUIMJ-NPOAOIOLSA-N |
| Literature Reference Author | K.C.WANG,P.H.WANG,S.S.LEE |
| Literature Reference Citation | J.NAT.PROD.,60,1236(1997) |
| Literature Reference DOI | 10.1021/np970331y |
| Molecular Weight | 434.660 g/mol |
| Solvent | CDCl3:CD3OD=3:1 |
| Source File Reference | UWRU357 |