| SpectraBase Compound ID | KDgE7eYOjH2 |
|---|---|
| InChI | InChI=1S/C28H42O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h13,15,17-18,20,23-26H,3,7-12,14,16H2,1-2,4-6H3/t20-,23+,24-,25+,26+,27+,28-/m1/s1 |
| InChIKey | UVAVWWCPGAHKIW-QVMRCSLBSA-N |
| Mol Weight | 394.6 g/mol |
| Molecular Formula | C28H42O |
| Exact Mass | 394.323566 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IGpVeUSNDV3 |
|---|---|
| Name | 24-METHYLENECHOLESTA-1,4,22-TRIEN-3-ONE |
| Compound Number | 8 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H42O |
| InChI | InChI=1S/C28H42O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h13,15,17-18,20,23-26H,3,7-12,14,16H2,1-2,4-6H3/t20-,23+,24-,25+,26+,27+,28-/m1/s1 |
| InChIKey | UVAVWWCPGAHKIW-QVMRCSLBSA-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 | 394.641 g/mol |
| Sample ID | 37530 |
| Solvent | CDCl3 |