| SpectraBase Compound ID | E2ym7PWoQg9 |
|---|---|
| InChI | InChI=1S/C42H70O14/c1-36(2)13-16-42(51,56-36)22(17-43)21-9-11-39(6)26-8-7-25-37(3,4)27(10-12-40(25)20-41(26,40)15-14-38(21,39)5)55-35-33(50)31(48)29(46)24(54-35)19-52-34-32(49)30(47)28(45)23(18-44)53-34/h21-35,43-51H,7-20H2,1-6H3/t21-,22+,23-,24-,25+,26+,27+,28-,29-,30+,31+,32-,33-,34-,35+,38-,39+,40-,41+,42-/m1/s1 |
| InChIKey | VMECDOSUDKQCOA-OIWDNSBRSA-N |
| Mol Weight | 799.0 g/mol |
| Molecular Formula | C42H70O14 |
| Exact Mass | 798.476557 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2StGIx2Kt9g |
|---|---|
| Name | 9,19-CYCLO-LANOSTA-22,25-EPOXY-3-BETA,21,22(R)-TRIOL-3-BETA-O-GENTIOBIOSIDE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C42H70O14 |
| InChI | InChI=1S/C42H70O14/c1-36(2)13-16-42(51,56-36)22(17-43)21-9-11-39(6)26-8-7-25-37(3,4)27(10-12-40(25)20-41(26,40)15-14-38(21,39)5)55-35-33(50)31(48)29(46)24(54-35)19-52-34-32(49)30(47)28(45)23(18-44)53-34/h21-35,43-51H,7-20H2,1-6H3/t21-,22+,23-,24-,25+,26+,27+,28-,29-,30+,31+,32-,33-,34-,35+,38-,39+,40-,41+,42-/m1/s1 |
| InChIKey | VMECDOSUDKQCOA-OIWDNSBRSA-N |
| Literature Reference Author | F.ORSINI,F.PELIZZONI,G.RICCA,L.VEROTTA |
| Literature Reference Citation | PHYTOCHEM.,26,1101(1987) |
| Literature Reference DOI | 10.1016/S0031-9422(00)82358-4 |
| Molecular Weight | 799.009 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWBK527 |