SpectraBase Compound ID | 1WEzmKnJ1Em |
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InChI | InChI=1S/C44H70O17/c1-19-8-13-43(55-17-19)21(3)44(53)29(61-43)15-26-24-7-6-22-14-23(9-11-41(22,4)25(24)10-12-42(26,44)5)57-40-37(60-39-34(51)32(49)30(47)20(2)56-39)35(52)36(28(16-45)58-40)59-38-33(50)31(48)27(46)18-54-38/h6,19-21,23-40,45-53H,7-18H2,1-5H3/t19-,20-,21+,23-,24+,25-,26-,27-,28+,29-,30-,31-,32+,33+,34+,35-,36+,37+,38-,39-,40+,41-,42-,43+,44+/m0/s1 |
InChIKey | MXFOMMHAIRXMFQ-YRLMEPPGSA-N |
Mol Weight | 871.0 g/mol |
Molecular Formula | C44H70O17 |
Exact Mass | 870.461301 g/mol |
SpectraBase Spectrum ID | 82YvpC0ZiSB |
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Name | PENNOGENIN-3-O-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-[ALPHA-L-ARABINOPYRANOSYL-(1->4)]-BETA-D-GLUCOPYRANOSID |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C44H70O17 |
InChI | InChI=1S/C44H70O17/c1-19-8-13-43(55-17-19)21(3)44(53)29(61-43)15-26-24-7-6-22-14-23(9-11-41(22,4)25(24)10-12-42(26,44)5)57-40-37(60-39-34(51)32(49)30(47)20(2)56-39)35(52)36(28(16-45)58-40)59-38-33(50)31(48)27(46)18-54-38/h6,19-21,23-40,45-53H,7-18H2,1-5H3/t19-,20-,21+,23-,24+,25-,26-,27-,28+,29-,30-,31-,32+,33+,34+,35-,36+,37+,38-,39-,40+,41-,42-,43+,44+/m0/s1 |
InChIKey | MXFOMMHAIRXMFQ-YRLMEPPGSA-N |
Literature Reference Author | P.K.AGRAWAL,D.C.JAIN,R.K.GUPTA,R.S.THAKUR |
Literature Reference Citation | PHYTOCHEM.,24,2479(1985) |
Literature Reference DOI | 10.1016/S0031-9422(00)80653-6 |
Molecular Weight | 871.030 g/mol |
Solvent | PYRIDINE-D5 |
Source File Reference | UNIW17178 |