SpectraBase Compound ID | 9iHSMdRUqqc |
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InChI | InChI=1S/C59H94O28/c1-22-32(64)36(68)39(71)49(79-22)83-43-35(67)27(20-61)81-51(42(43)74)86-46-44(84-48-38(70)33(65)25(62)21-78-48)41(73)45(47(75)76)85-52(46)82-31-12-13-56(6)28(55(31,4)5)11-14-57(7)29(56)10-9-23-24-17-54(2,3)15-16-59(24,30(63)18-58(23,57)8)53(77)87-50-40(72)37(69)34(66)26(19-60)80-50/h9,22,24-46,48-52,60-74H,10-21H2,1-8H3,(H,75,76)/t22-,24+,25-,26-,27+,28+,29-,30-,31+,32-,33+,34-,35+,36+,37+,38-,39+,40-,41+,42+,43-,44+,45+,46-,48+,49-,50+,51-,52-,56+,57-,58-,59-/m1/s1 |
InChIKey | LPBOZSLWWLQGRY-SJQRLHDGSA-N |
Mol Weight | 1251.4 g/mol |
Molecular Formula | C59H94O28 |
Exact Mass | 1250.593162 g/mol |
SpectraBase Spectrum ID | GfWmUhcMZid |
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Name | GORDONOSIDE_P;3-O-ALPHA-L-RHAMNOPYRANOSYL-(1->3)-BETA-D-GLUCOPYRANOSYL-(1->2)-[BETA-D-XYLOPYRANOSYL-(1->3)]-BETA-D-GLUCURONO |
Compound Number | 8 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C59H94O28 |
InChI | InChI=1S/C59H94O28/c1-22-32(64)36(68)39(71)49(79-22)83-43-35(67)27(20-61)81-51(42(43)74)86-46-44(84-48-38(70)33(65)25(62)21-78-48)41(73)45(47(75)76)85-52(46)82-31-12-13-56(6)28(55(31,4)5)11-14-57(7)29(56)10-9-23-24-17-54(2,3)15-16-59(24,30(63)18-58(23,57)8)53(77)87-50-40(72)37(69)34(66)26(19-60)80-50/h9,22,24-46,48-52,60-74H,10-21H2,1-8H3,(H,75,76)/t22-,24+,25-,26-,27+,28+,29-,30-,31+,32-,33+,34-,35+,36+,37+,38-,39+,40-,41+,42+,43-,44+,45+,46-,48+,49-,50+,51-,52-,56+,57-,58-,59-/m1/s1 |
InChIKey | LPBOZSLWWLQGRY-SJQRLHDGSA-N |
Literature Reference Author | H.Z.FU,C.J.LI,J.Z.YANG,Z.F.SHEN,D.M.ZHANG |
Literature Reference Citation | J.NAT.PROD.,74,1066(2011) |
Literature Reference DOI | 10.1021/np200021f |
Molecular Weight | 1251.379 g/mol |
Sample ID | 38147 |
Solvent | C5D5N |