| SpectraBase Compound ID | 2vbb7xLes9W |
|---|---|
| InChI | InChI=1S/C27H40O/c1-17(2)18(3)6-7-19(4)25-12-13-26-24-10-8-20-16-21(28)9-11-22(20)23(24)14-15-27(25,26)5/h6-7,9,11,16-19,23-26,28H,8,10,12-15H2,1-5H3/b7-6+/t18-,19-,23-,24-,25-,26+,27-/m1/s1 |
| InChIKey | NXXMTWFZPIADGB-RDBPJOJYSA-N |
| Mol Weight | 380.6 g/mol |
| Molecular Formula | C27H40O |
| Exact Mass | 380.307916 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BC4Sps6WGXs |
|---|---|
| Name | (22-E,24-S)-24-METHYL-19-NORCHOLESTA-1,3,5-(10),22-TETRAEN-3-OL |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H40O |
| InChI | InChI=1S/C27H40O/c1-17(2)18(3)6-7-19(4)25-12-13-26-24-10-8-20-16-21(28)9-11-22(20)23(24)14-15-27(25,26)5/h6-7,9,11,16-19,23-26,28H,8,10,12-15H2,1-5H3/b7-6+/t18-,19-,23-,24-,25-,26+,27-/m1/s1 |
| InChIKey | NXXMTWFZPIADGB-RDBPJOJYSA-N |
| Literature Reference Author | X.H.YAN,H.L.LIU,H.HUANG,X.B.LI,Y.W.GUO |
| Literature Reference Citation | J.NAT.PROD.,74,175(2011) |
| Literature Reference DOI | 10.1021/np100562n |
| Molecular Weight | 380.614 g/mol |
| Sample ID | 37527 |
| Solvent | CDCl3 |