| SpectraBase Compound ID | GxCz91AJ13I |
|---|---|
| InChI | InChI=1S/C30H52O5/c1-18(8-9-19(2)27(4,5)35-20(3)31)23-10-11-24-22-16-26(33)30(34)17-21(32)12-15-29(30,7)25(22)13-14-28(23,24)6/h18-19,21-26,32-34H,8-17H2,1-7H3/t18-,19-,21+,22+,23-,24+,25+,26-,28-,29-,30+/m1/s1 |
| InChIKey | NTYRSMDNACWFJE-GGCFKELASA-N |
| Mol Weight | 492.7 g/mol |
| Molecular Formula | C30H52O5 |
| Exact Mass | 492.381475 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AbZ4793Imv6 |
|---|---|
| Name | (24S)-ERGOSTANE-3-BETA,5-ALPHA,6-BETA,25-TETRAOL-25-MONOACETATE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H52O5 |
| InChI | InChI=1S/C30H52O5/c1-18(8-9-19(2)27(4,5)35-20(3)31)23-10-11-24-22-16-26(33)30(34)17-21(32)12-15-29(30,7)25(22)13-14-28(23,24)6/h18-19,21-26,32-34H,8-17H2,1-7H3/t18-,19-,21+,22+,23-,24+,25+,26-,28-,29-,30+/m1/s1 |
| InChIKey | NTYRSMDNACWFJE-GGCFKELASA-N |
| Literature Reference Author | B.L.RAJU,G.V.SUBBARAJU,M.C.REDDY,D.V.RAO,C.B.RAO,V.S.RAJU |
| Literature Reference Citation | J.NAT.PROD.,55,904(1992) |
| Literature Reference DOI | 10.1021/np50085a009 |
| Molecular Weight | 492.740 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWCS5566 |