SpectraBase Compound ID | KVlnlG9u4rR |
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InChI | InChI=1S/2C42H32O9/c43-23-7-1-19(2-8-23)33-35(22-13-26(46)15-27(47)14-22)40-34(20-3-9-24(44)10-4-20)36-29(16-28(48)17-30(36)49)37-39-32(18-31(50)38(33)41(39)40)51-42(37)21-5-11-25(45)12-6-21;43-23-8-4-19(5-9-23)33-35(22-13-26(46)15-27(47)14-22)40-34(21-2-1-3-25(45)12-21)36-29(16-28(48)17-30(36)49)37-39-32(18-31(50)38(33)41(39)40)51-42(37)20-6-10-24(44)11-7-20/h2*1-18,33-35,37,40,42-50H/t2*33-,34-,35-,37-,40+,42+/m00/s1 |
InChIKey | KINXMNLHNZNQCY-UOZOHOIWSA-N |
Mol Weight | 1361.4 g/mol |
Molecular Formula | C84H64O18 |
Exact Mass | 1360.409265 g/mol |
SpectraBase Spectrum ID | DUnueT5BFwq |
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Name | AMPELOPSIN-C |
Compound Number | 2 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C84H64O18 |
InChI | InChI=1S/2C42H32O9/c43-23-7-1-19(2-8-23)33-35(22-13-26(46)15-27(47)14-22)40-34(20-3-9-24(44)10-4-20)36-29(16-28(48)17-30(36)49)37-39-32(18-31(50)38(33)41(39)40)51-42(37)21-5-11-25(45)12-6-21;43-23-8-4-19(5-9-23)33-35(22-13-26(46)15-27(47)14-22)40-34(21-2-1-3-25(45)12-21)36-29(16-28(48)17-30(36)49)37-39-32(18-31(50)38(33)41(39)40)51-42(37)20-6-10-24(44)11-7-20/h2*1-18,33-35,37,40,42-50H/t2*33-,34-,35-,37-,40+,42+/m00/s1 |
InChIKey | KINXMNLHNZNQCY-UOZOHOIWSA-N |
Literature Reference Author | W.W.LI,L.S.DING,B.G.LI,Y.Z.CHEN |
Literature Reference Citation | PHYTOCHEM.,42,1163(1996) |
Literature Reference DOI | 10.1016/0031-9422(96)00069-6 |
Molecular Weight | 1361.421 g/mol |
Solvent | ACETONE-D6 |
Source File Reference | UWVN2990 |