| SpectraBase Compound ID | FyUIuX5wSNB |
|---|---|
| InChI | InChI=1S/C30H51BrO7/c1-19(9-10-22(32)27(6)16-13-23(36-27)25(2,3)33)20-11-18-30(35-20)29(8,34)17-14-24(37-30)28(7)15-12-21(31)26(4,5)38-28/h20-24,32-34H,1,9-18H2,2-8H3/t20-,21-,22-,23-,24-,27+,28+,29+,30+/m1/s1 |
| InChIKey | UMYRCGIBKPWTMV-OURBBAPVSA-N |
| Mol Weight | 603.6 g/mol |
| Molecular Formula | C30H51BrO7 |
| Exact Mass | 602.281817 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Hs6YQ8VgLLe |
|---|---|
| Name | SPIRO-DEHYDRO-VENUSTATRIOL |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H51BrO7 |
| InChI | InChI=1S/C30H51BrO7/c1-19(9-10-22(32)27(6)16-13-23(36-27)25(2,3)33)20-11-18-30(35-20)29(8,34)17-14-24(37-30)28(7)15-12-21(31)26(4,5)38-28/h20-24,32-34H,1,9-18H2,2-8H3/t20-,21-,22-,23-,24-,27+,28+,29+,30+/m1/s1 |
| InChIKey | UMYRCGIBKPWTMV-OURBBAPVSA-N |
| Literature Reference Author | F.CEN-PACHECO,L.NORDSTROEM,M.L.SOUTO,M.N.MARTIN,J.J.FERNANDE Z,A.H.DARANAS |
| Literature Reference Citation | MAR.DRUGS,8,1178(2010) |
| Literature Reference DOI | 10.3390/md8041178 |
| Molecular Weight | 603.635 g/mol |
| Source File Reference | UWIR6211 |