| SpectraBase Compound ID | KflHLSFgMBa |
|---|---|
| InChI | InChI=1S/C27H46O2/c1-17(2)7-6-8-18(3)21-9-10-22-20-16-25(29)24-15-19(28)11-13-27(24,5)23(20)12-14-26(21,22)4/h17-19,21-22,24-25,28-29H,6-16H2,1-5H3/t18-,19+,21-,22+,24-,25+,26-,27-/m1/s1 |
| InChIKey | MPCLLXXLNXORCU-YCNUQCQXSA-N |
| Mol Weight | 402.7 g/mol |
| Molecular Formula | C27H46O2 |
| Exact Mass | 402.349781 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FexCSpogs5q |
|---|---|
| Name | DELTA-(8)-3-BETA,6-ALPHA-CHOLESTENDIOL |
| CAS Registry Number | 570-92-3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H46O2 |
| InChI | InChI=1S/C27H46O2/c1-17(2)7-6-8-18(3)21-9-10-22-20-16-25(29)24-15-19(28)11-13-27(24,5)23(20)12-14-26(21,22)4/h17-19,21-22,24-25,28-29H,6-16H2,1-5H3/t18-,19+,21-,22+,24-,25+,26-,27-/m1/s1 |
| InChIKey | MPCLLXXLNXORCU-YCNUQCQXSA-N |
| Literature Reference Author | H.EGGERT,C.DJERASSI |
| Literature Reference Citation | J.ORG.CHEM.,46,5399(1981) |
| Literature Reference DOI | 10.1021/jo00339a031 |
| Molecular Weight | 402.661 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UNIW12750 |