| SpectraBase Compound ID | 9VKjNW41mfq |
|---|---|
| InChI | InChI=1S/C28H48O6/c1-15(17(3)14-29)6-7-16(2)18-12-20(31)25-26(18,4)11-9-22-27(5)10-8-19(30)24(33)23(27)21(32)13-28(22,25)34/h6-7,15-25,29-34H,8-14H2,1-5H3/b7-6+/t15-,16+,17-,18?,19-,20+,21-,22?,23-,24-,25?,26+,27+,28-/m0/s1 |
| InChIKey | UZMSBSHNTQAMIG-FTFOXCTPSA-N |
| Mol Weight | 480.7 g/mol |
| Molecular Formula | C28H48O6 |
| Exact Mass | 480.345089 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DAu3IYeaU6V |
|---|---|
| Name | CERTONARDOSTEROL_A2;(E)-(24R,25S)-24-METHYL-5-ALPHA-CHOLEST-22-ENE-3-BETA,4-BETA,6-ALPHA,8,15-BETA,26-HEXOL |
| Compound Number | 11 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H48O6 |
| InChI | InChI=1S/C28H48O6/c1-15(17(3)14-29)6-7-16(2)18-12-20(31)25-26(18,4)11-9-22-27(5)10-8-19(30)24(33)23(27)21(32)13-28(22,25)34/h6-7,15-25,29-34H,8-14H2,1-5H3/b7-6+/t15-,16+,17-,18?,19-,20+,21-,22?,23-,24-,25?,26+,27+,28-/m0/s1 |
| InChIKey | UZMSBSHNTQAMIG-FTFOXCTPSA-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 | 480.686 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWMZ5684 |