| SpectraBase Compound ID | W3k3rfMDAQ |
|---|---|
| InChI | InChI=1S/C29H46O3/c1-17(2)18(3)21-15-22(21)19(4)23-7-8-24-26(23,5)11-10-25-27(6)12-9-20(30)16-28(27)13-14-29(24,25)32-31-28/h13-14,17-25,30H,7-12,15-16H2,1-6H3/t18-,19-,20+,21+,22+,23?,24?,25?,26-,27-,28-,29+/m1/s1 |
| InChIKey | FYNMKNFAKCHMLL-HXXXKEFKSA-N |
| Mol Weight | 442.7 g/mol |
| Molecular Formula | C29H46O3 |
| Exact Mass | 442.344695 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 86BpkGU4K5x |
|---|---|
| Name | (22-R,23-R,24-R)-5-ALPHA,8-ALPHA-EPI-DIOXY-22,23-METHYLENE-24-METHYL-CHOLEST-6-EN-3-BETA-OL |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H46O3 |
| InChI | InChI=1S/C29H46O3/c1-17(2)18(3)21-15-22(21)19(4)23-7-8-24-26(23,5)11-10-25-27(6)12-9-20(30)16-28(27)13-14-29(24,25)32-31-28/h13-14,17-25,30H,7-12,15-16H2,1-6H3/t18-,19-,20+,21+,22+,23?,24?,25?,26-,27-,28-,29+/m1/s1 |
| InChIKey | FYNMKNFAKCHMLL-HXXXKEFKSA-N |
| Literature Reference Author | J.H.SHEU,K.C.CHANG,C.Y.DUH |
| Literature Reference Citation | J.NAT.PROD.,63,149(2000) |
| Literature Reference DOI | 10.1021/np9903954 |
| Molecular Weight | 442.682 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWRU1773 |