SpectraBase Compound ID | GykbvEFqmRt |
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InChI | InChI=1S/C44H70O18/c1-17-12-28(47)44(62-38(17)54)18(2)29-26(61-44)14-24-22-7-6-20-13-21(8-10-42(20,4)23(22)9-11-43(24,29)5)57-41-37(60-40-35(53)33(51)30(48)19(3)56-40)36(32(50)27(15-45)58-41)59-39-34(52)31(49)25(46)16-55-39/h6,17-19,21-41,45-54H,7-16H2,1-5H3/t17-,18+,19-,21+,22-,23+,24+,25-,26+,27-,28+,29+,30-,31+,32-,33+,34-,35+,36+,37-,38-,39+,40-,41-,42+,43+,44-/m1/s1 |
InChIKey | YGPVRHSBAWKDQT-XSPDVPACSA-N |
Mol Weight | 887.0 g/mol |
Molecular Formula | C44H70O18 |
Exact Mass | 886.456215 g/mol |
SpectraBase Spectrum ID | AzktGMDAclJ |
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Name | INDIOSIDE-A;(23S,25R,26R)-SPIROST-5-EN-3-BETA,23,26-TRIOL-3-O-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)-[BETA-D-XYLOPARANOSYL-(1->3)]-BETA-D-GLUCOPYRANOSIDE] |
Compound Number | 1 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C44H70O18 |
InChI | InChI=1S/C44H70O18/c1-17-12-28(47)44(62-38(17)54)18(2)29-26(61-44)14-24-22-7-6-20-13-21(8-10-42(20,4)23(22)9-11-43(24,29)5)57-41-37(60-40-35(53)33(51)30(48)19(3)56-40)36(32(50)27(15-45)58-41)59-39-34(52)31(49)25(46)16-55-39/h6,17-19,21-41,45-54H,7-16H2,1-5H3/t17-,18+,19-,21+,22-,23+,24+,25-,26+,27-,28+,29+,30-,31+,32-,33+,34-,35+,36+,37-,38-,39+,40-,41-,42+,43+,44-/m1/s1 |
InChIKey | YGPVRHSBAWKDQT-XSPDVPACSA-N |
Literature Reference Author | S.YAHARA,T.NALAMURA,Y.SOMEYA,T.MATSUMOTO,T.YAMASHITA,T.NOHAR A |
Literature Reference Citation | PHYTOCHEM.,43,1319(1996) |
Literature Reference DOI | 10.1016/S0031-9422(96)00395-0 |
Molecular Weight | 887.029 g/mol |
Solvent | C5D5N |
Source File Reference | UWMS2410 |