| SpectraBase Compound ID | EJPNxZp44D7 |
|---|---|
| InChI | InChI=1S/C34H56O5/c1-21(10-13-28(30(6,7)37)39-23(3)36)24-14-16-32(9)26-12-11-25-29(4,5)27(38-22(2)35)15-17-33(25)20-34(26,33)19-18-31(24,32)8/h21,24-28,37H,10-20H2,1-9H3/t21?,24-,25+,26+,27+,28?,31-,32+,33-,34+/m1/s1 |
| InChIKey | GFYZJFMIMJHXNL-XXAPKECKSA-N |
| Mol Weight | 544.8 g/mol |
| Molecular Formula | C34H56O5 |
| Exact Mass | 544.412775 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EOGKouGcXIS |
|---|---|
| Name | CYCLOARTANE-3-BETA,24,25-TRIOL-DIACETATE;ISOMER-#2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H56O5 |
| InChI | InChI=1S/C34H56O5/c1-21(10-13-28(30(6,7)37)39-23(3)36)24-14-16-32(9)26-12-11-25-29(4,5)27(38-22(2)35)15-17-33(25)20-34(26,33)19-18-31(24,32)8/h21,24-28,37H,10-20H2,1-9H3/t21?,24-,25+,26+,27+,28?,31-,32+,33-,34+/m1/s1 |
| InChIKey | GFYZJFMIMJHXNL-XXAPKECKSA-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 | 544.816 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCS7872 |