| SpectraBase Compound ID | 6AkUe0RuYwQ |
|---|---|
| InChI | InChI=1S/C29H50O3/c1-18(2)8-7-9-19(3)23-10-11-24-27-25(13-15-29(23,24)6)28(5)14-12-22(32-20(4)30)16-21(28)17-26(27)31/h18-19,21-27,31H,7-17H2,1-6H3/t19-,21-,22+,23-,24+,25+,26-,27+,28+,29-/m1/s1 |
| InChIKey | KDJPNDQOTCHXMI-IBSXMJBXSA-N |
| Mol Weight | 446.7 g/mol |
| Molecular Formula | C29H50O3 |
| Exact Mass | 446.375995 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EZfWqi56Ygg |
|---|---|
| Name | 3-BETA-ACETOXY-5-ALPHA-CHOLESTAN-7-ALPHA-OL |
| CAS Registry Number | 40823-41-4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H50O3 |
| InChI | InChI=1S/C29H50O3/c1-18(2)8-7-9-19(3)23-10-11-24-27-25(13-15-29(23,24)6)28(5)14-12-22(32-20(4)30)16-21(28)17-26(27)31/h18-19,21-27,31H,7-17H2,1-6H3/t19-,21-,22+,23-,24+,25+,26-,27+,28+,29-/m1/s1 |
| InChIKey | KDJPNDQOTCHXMI-IBSXMJBXSA-N |
| Literature Reference Author | C.L.VANANTWERP,H.EGGERT,G.D.MEAKINS,J.O.MINERS,C.DJERASSI |
| Literature Reference Citation | J.ORG.CHEM.,42,789(1977) |
| Literature Reference DOI | 10.1021/jo00425a005 |
| Molecular Weight | 446.714 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UNIW9709 |