SpectraBase Compound ID | EjSc9QqaiQz |
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InChI | InChI=1S/C58H92O28/c1-53(2)14-15-58(52(76)86-49-40(72)37(69)35(67)27(19-60)80-49)23(16-53)22-8-9-29-55(5)12-11-31(54(3,4)28(55)10-13-56(29,6)57(22,7)17-30(58)63)81-51-45(85-48-39(71)36(68)34(66)26(18-59)79-48)42(41(73)43(83-51)46(74)75)82-50-44(33(65)25(62)21-78-50)84-47-38(70)32(64)24(61)20-77-47/h8,23-45,47-51,59-73H,9-21H2,1-7H3,(H,74,75)/t23-,24-,25+,26+,27+,28-,29+,30+,31-,32+,33+,34+,35+,36-,37-,38-,39+,40+,41+,42+,43+,44-,45-,47+,48-,49-,50+,51-,55-,56+,57+,58+/m0/s1 |
InChIKey | GNQHWAAORKJVMT-JJDDWMERSA-N |
Mol Weight | 1237.3 g/mol |
Molecular Formula | C58H92O28 |
Exact Mass | 1236.577512 g/mol |
SpectraBase Spectrum ID | EJGte5VBKlZ |
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Name | GORDONOSIDE_N;3-O-BETA-D-XYLOPYRANOSYL-(1->2)-ALPHA-L-ARABINOPYRANOSYL-(1->3)-[BETA-D-GLUCOPYRANOSYL-(1->2)]-BETA-D-GLUCURONOPYRANOSYL |
Compound Number | 6 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C58H92O28 |
InChI | InChI=1S/C58H92O28/c1-53(2)14-15-58(52(76)86-49-40(72)37(69)35(67)27(19-60)80-49)23(16-53)22-8-9-29-55(5)12-11-31(54(3,4)28(55)10-13-56(29,6)57(22,7)17-30(58)63)81-51-45(85-48-39(71)36(68)34(66)26(18-59)79-48)42(41(73)43(83-51)46(74)75)82-50-44(33(65)25(62)21-78-50)84-47-38(70)32(64)24(61)20-77-47/h8,23-45,47-51,59-73H,9-21H2,1-7H3,(H,74,75)/t23-,24-,25+,26+,27+,28-,29+,30+,31-,32+,33+,34+,35+,36-,37-,38-,39+,40+,41+,42+,43+,44-,45-,47+,48-,49-,50+,51-,55-,56+,57+,58+/m0/s1 |
InChIKey | GNQHWAAORKJVMT-JJDDWMERSA-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 | 1237.352 g/mol |
Sample ID | 38145 |
Solvent | C5D5N |