| SpectraBase Compound ID | 5n7xwmNiXPD |
|---|---|
| InChI | InChI=1S/C41H72O10/c1-7-8-9-10-11-12-13-14-15-16-17-37-38(51-41(5,6)50-37)21-19-31-26-32(49-40(3,4)48-31)27-34(44)36-23-22-35(47-36)33(43)20-18-30(42)25-29-24-28(2)46-39(29)45/h24,28,30-38,42-44H,7-23,25-27H2,1-6H3/t28?,30?,31-,32+,33+,34+,35+,36+,37+,38+/m0/s1 |
| InChIKey | YPDQWYRKCLVYAJ-HJOVYBOPSA-N |
| Mol Weight | 725.0 g/mol |
| Molecular Formula | C41H72O10 |
| Exact Mass | 724.512549 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IxOkBxpLpIz |
|---|---|
| Name | CORIAHEPTOCIN-B-14,16,19,20-DIACETONIDE |
| Compound Number | 2A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C41H72O10 |
| InChI | InChI=1S/C41H72O10/c1-7-8-9-10-11-12-13-14-15-16-17-37-38(51-41(5,6)50-37)21-19-31-26-32(49-40(3,4)48-31)27-34(44)36-23-22-35(47-36)33(43)20-18-30(42)25-29-24-28(2)46-39(29)45/h24,28,30-38,42-44H,7-23,25-27H2,1-6H3/t28?,30?,31-,32+,33+,34+,35+,36+,37+,38+/m0/s1 |
| InChIKey | YPDQWYRKCLVYAJ-HJOVYBOPSA-N |
| Literature Reference Author | E.L.M.DASILVA,F.ROBLOT,O.LAPREVOTE,L.SERANI,A.CAVE |
| Literature Reference Citation | J.NAT.PROD.,60,162(1997) |
| Literature Reference DOI | 10.1021/np9606660 |
| Molecular Weight | 725.017 g/mol |
| Solvent | CDCl3:CD3OD=95:5 |
| Source File Reference | UWGS96 |