SpectraBase Compound ID | 7RPJZmlAjEv |
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InChI | InChI=1S/C42H68O13/c1-37(2)14-16-42(36(50)51)17-15-40(6)21(22(42)18-37)8-9-26-39(5)12-11-27(38(3,4)25(39)10-13-41(26,40)7)54-35-32(49)33(29(46)24(20-44)53-35)55-34-31(48)30(47)28(45)23(19-43)52-34/h8,22-35,43-49H,9-20H2,1-7H3,(H,50,51)/t22?,23-,24-,25?,26?,27+,28+,29-,30+,31-,32-,33+,34+,35+,39+,40-,41-,42+/m1/s1 |
InChIKey | KZIQZLSHACGNHX-YBJXTOQASA-N |
Mol Weight | 781.0 g/mol |
Molecular Formula | C42H68O13 |
Exact Mass | 780.465992 g/mol |
SpectraBase Spectrum ID | DQRTYUmZglR |
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Name | ARVENOSIDE-B |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C42H68O13 |
InChI | InChI=1S/C42H68O13/c1-37(2)14-16-42(36(50)51)17-15-40(6)21(22(42)18-37)8-9-26-39(5)12-11-27(38(3,4)25(39)10-13-41(26,40)7)54-35-32(49)33(29(46)24(20-44)53-35)55-34-31(48)30(47)28(45)23(19-43)52-34/h8,22-35,43-49H,9-20H2,1-7H3,(H,50,51)/t22?,23-,24-,25?,26?,27+,28+,29-,30+,31-,32-,33+,34+,35+,39+,40-,41-,42+/m1/s1 |
InChIKey | KZIQZLSHACGNHX-YBJXTOQASA-N |
Literature Reference Author | R.CHEMLI,A.BABADJAMIAN,R.FAURE,K.BOUKEF,G.BALANSARD,E.VIDAL |
Literature Reference Citation | PHYTOCHEM.,26,1785(1987) |
Literature Reference DOI | 10.1016/S0031-9422(00)82288-8 |
Molecular Weight | 780.994 g/mol |
Solvent | DMSO-D6 |
Source File Reference | UWBK515 |