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Substance Name: 4H-1-Benzopyran-4-one, 5-((6-deoxy-4-O-beta-D-glucopyranosyl-alpha-L-mannopyranosyl)oxy)-2-(3,4-dimethoxyphenyl)-3,6,7-trimethoxy-
RN: 73815-14-2
InChIKey: PAJMMZMRJVANIH-VGZDEVELSA-N

Molecular Formula

  • C32-H40-O17

Molecular Weight

  • 696.651
 
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Names and Synonyms

  • 4H-1-Benzopyran-4-one, 5-((6-deoxy-4-O-beta-D-glucopyranosyl-alpha-L-mannopyranosyl)oxy)-2-(3,4-dimethoxyphenyl)-3,6,7-trimethoxy-

Registry Numbers

CAS Registry Number

  • 73815-14-2

System Generated Number

  • 0073815142

Structure Descriptors

InChI

1S/C32H40O17/c1-12-26(48-32-24(38)22(36)20(34)18(11-33)47-32)23(37)25(39)31(45-12)49-29-19-16(10-17(42-4)28(29)43-5)46-27(30(44-6)21(19)35)13-7-8-14(40-2)15(9-13)41-3/h7-10,12,18,20,22-26,31-34,36-39H,11H2,1-6H3/t12-,18+,20+,22-,23-,24+,25+,26?,31?,32-/m0/s1

InChIKey

PAJMMZMRJVANIH-VGZDEVELSA-N

Smiles

COC1=C(Oc2cc(OC)c(OC)c(OC3O[C@@H](C)C(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](O)[C@H]3O)c2C1=O)c5ccc(OC)c(OC)c5