SpectraBase Compound ID | JWQTevjPr2X |
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InChI | InChI=1S/C42H68O14/c1-21(8-7-9-22(17-43)20-53-37-35(51)33(49)31(47)26(18-44)54-37)23-14-15-40(4)28-12-10-24-25(42(28,6)29(46)16-41(23,40)5)11-13-30(39(24,2)3)56-38-36(52)34(50)32(48)27(19-45)55-38/h9-10,21,23,25-28,30-38,43-45,47-52H,7-8,11-20H2,1-6H3/b22-9+ |
InChIKey | MRMWADAGNSNVKO-LSFURLLWSA-N |
Mol Weight | 797.0 g/mol |
Molecular Formula | C42H68O14 |
Exact Mass | 796.460907 g/mol |
SpectraBase Spectrum ID | 2yGXdZh0Im6 |
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Name | JINFUSHANOSIDE_C;27-HYDROXY-3-O-(BETA-D-GLUCOPYRANOSYL)-26-O-(BETA-D-GLUCOPYRANOSYL)-CUCURBIT-5,24-DIEN-11-ONE |
Compound Number | 3 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C42H68O14 |
InChI | InChI=1S/C42H68O14/c1-21(8-7-9-22(17-43)20-53-37-35(51)33(49)31(47)26(18-44)54-37)23-14-15-40(4)28-12-10-24-25(42(28,6)29(46)16-41(23,40)5)11-13-30(39(24,2)3)56-38-36(52)34(50)32(48)27(19-45)55-38/h9-10,21,23,25-28,30-38,43-45,47-52H,7-8,11-20H2,1-6H3/b22-9+ |
InChIKey | MRMWADAGNSNVKO-LSFURLLWSA-N |
Literature Reference Author | J.C.CHEN,X.M.NIU,Z.R.LI,M.H.QIU |
Literature Reference Citation | PLANTA.MED.,71,983(2005) |
Literature Reference DOI | 10.1055/s-2005-873110 |
Molecular Weight | 796.994 g/mol |
Solvent | C5D5N |
Source File Reference | UWMZ48113 |