| SpectraBase Compound ID | CjSIejlLG63 |
|---|---|
| InChI | InChI=1S/C30H52O3/c1-19(8-11-24(32)26(4,5)33)20-12-14-28(7)22-10-9-21-25(2,3)23(31)13-15-29(21)18-30(22,29)17-16-27(20,28)6/h19-24,31-33H,8-18H2,1-7H3/t19?,20-,21+,22+,23+,24?,27-,28+,29-,30+/m1/s1 |
| InChIKey | BKRIPHYESIGPJC-MYTGMYFESA-N |
| Mol Weight | 460.7 g/mol |
| Molecular Formula | C30H52O3 |
| Exact Mass | 460.391646 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | TsLlNS4sId |
|---|---|
| Name | CYCLOARTANE-3-BETA,24,25-TRIOL;ISOMER-#1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H52O3 |
| InChI | InChI=1S/C30H52O3/c1-19(8-11-24(32)26(4,5)33)20-12-14-28(7)22-10-9-21-25(2,3)23(31)13-15-29(21)18-30(22,29)17-16-27(20,28)6/h19-24,31-33H,8-18H2,1-7H3/t19?,20-,21+,22+,23+,24?,27-,28+,29-,30+/m1/s1 |
| InChIKey | BKRIPHYESIGPJC-MYTGMYFESA-N |
| Literature Reference Author | J.DEPASCUALTERESA,J.G.URONES,I.S.MARCOS,P.BASABE,M.J.S.CUADR ADO,R.F.MORO |
| Literature Reference Citation | PHYTOCHEM.,26,1767(1987) |
| Literature Reference DOI | 10.1016/S0031-9422(00)82286-4 |
| Molecular Weight | 460.741 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCS7873 |