| SpectraBase Compound ID | 56Q7iS46vRZ |
|---|---|
| InChI | InChI=1S/C28H44O3/c1-17(2)18(3)6-7-19(4)22-8-9-23-26-24(11-12-27(22,23)5)28(16-29)13-10-21(30)14-20(28)15-25(26)31/h15,17,19,21-24,26,29-30H,3,6-14,16H2,1-2,4-5H3/t19-,21+,22-,23+,24+,26+,27-,28-/m1/s1 |
| InChIKey | FGABCPDHQVLZCA-JWLCXGMDSA-N |
| Mol Weight | 428.7 g/mol |
| Molecular Formula | C28H44O3 |
| Exact Mass | 428.329045 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 85zQki4o0bC |
|---|---|
| Name | 24-METHYLCHOLESTA-5,24(28)-DIENE-3-BETA,19-DIOL-7-ONE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H44O3 |
| InChI | InChI=1S/C28H44O3/c1-17(2)18(3)6-7-19(4)22-8-9-23-26-24(11-12-27(22,23)5)28(16-29)13-10-21(30)14-20(28)15-25(26)31/h15,17,19,21-24,26,29-30H,3,6-14,16H2,1-2,4-5H3/t19-,21+,22-,23+,24+,26+,27-,28-/m1/s1 |
| InChIKey | FGABCPDHQVLZCA-JWLCXGMDSA-N |
| Literature Reference Author | C.Y.DUH,S.K.WANG,M.J.CHU,J.H.SHEU |
| Literature Reference Citation | J.NAT.PROD.,61,1022(1998) |
| Literature Reference DOI | 10.1021/np9800497 |
| Molecular Weight | 428.656 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWRK3469 |