| SpectraBase Compound ID | 1PJKpzNLXnz |
|---|---|
| InChI | InChI=1S/C34H56O8/c1-19(10-11-20(2)31(6,7)38)26-12-13-27-25-17-30(42-23(5)37)34(39)18-24(40-21(3)35)16-29(41-22(4)36)33(34,9)28(25)14-15-32(26,27)8/h19-20,24-30,38-39H,10-18H2,1-9H3/t19-,20-,24+,25+,26-,27+,28+,29-,30-,32-,33+,34+/m1/s1 |
| InChIKey | CGHUDHFRBKTSLS-KMUYWNSASA-N |
| Mol Weight | 592.8 g/mol |
| Molecular Formula | C34H56O8 |
| Exact Mass | 592.397519 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IDBqqg1Otu2 |
|---|---|
| Name | (24S)-ERGOSTANE-1-BETA,3-BETA,5-ALPHA,6-BETA,25-PENTAOL-1,3,6-TRIACETATE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H56O8 |
| InChI | InChI=1S/C34H56O8/c1-19(10-11-20(2)31(6,7)38)26-12-13-27-25-17-30(42-23(5)37)34(39)18-24(40-21(3)35)16-29(41-22(4)36)33(34,9)28(25)14-15-32(26,27)8/h19-20,24-30,38-39H,10-18H2,1-9H3/t19-,20-,24+,25+,26-,27+,28+,29-,30-,32-,33+,34+/m1/s1 |
| InChIKey | CGHUDHFRBKTSLS-KMUYWNSASA-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 | 592.814 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCS5569 |