| SpectraBase Compound ID | 6kcuwLoiCR4 |
|---|---|
| InChI | InChI=1S/C29H52O4/c1-17(2)19(10-13-30)7-6-18(3)23-16-26(33)27-21-15-25(32)24-14-20(31)8-11-28(24,4)22(21)9-12-29(23,27)5/h17-27,30-33H,6-16H2,1-5H3/t18-,19+,20+,21-,22?,23-,24-,25+,26-,27?,28-,29-/m1/s1 |
| InChIKey | BKDLTBPGTMXGMR-RBYAKKMBSA-N |
| Mol Weight | 464.7 g/mol |
| Molecular Formula | C29H52O4 |
| Exact Mass | 464.38656 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | H3ITUfAgDvR |
|---|---|
| Name | CERTONARDOSTEROL_D3;(24R)-24-ETHYL-5-ALPHA-CHOLESTANE-3-BETA,6-ALPHA,15-BETA,24(2)-TETROL |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H52O4 |
| InChI | InChI=1S/C29H52O4/c1-17(2)19(10-13-30)7-6-18(3)23-16-26(33)27-21-15-25(32)24-14-20(31)8-11-28(24,4)22(21)9-12-29(23,27)5/h17-27,30-33H,6-16H2,1-5H3/t18-,19+,20+,21-,22?,23-,24-,25+,26-,27?,28-,29-/m1/s1 |
| InChIKey | BKDLTBPGTMXGMR-RBYAKKMBSA-N |
| Literature Reference Author | W.WANG,J.HONG,C.O.LEE,K.S.IM,J.S.CHOI,J.H.JUNG |
| Literature Reference Citation | J.NAT.PROD.,67,584(2004) |
| Literature Reference DOI | 10.1021/np030427u |
| Molecular Weight | 464.729 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWMZ5675 |