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Substance Name: beta-D-Glucopyranosiduronic acid, 4-(2-chloro-1-(4-methoxyphenyl)ethenyl)phenyl
RN: 79639-28-4
InChIKey: QDIUCJQLPVGRDZ-BCBLFFMGSA-N

Molecular Formula

  • C21-H21-Cl-O8

Molecular Weight

  • 436.842
 
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Names and Synonyms

  • beta-D-Glucopyranosiduronic acid, 4-(2-chloro-1-(4-methoxyphenyl)ethenyl)phenyl

Registry Numbers

CAS Registry Number

  • 79639-28-4

System Generated Number

  • 0079639284

Structure Descriptors

InChI

1S/C21H21ClO8/c1-28-13-6-2-11(3-7-13)15(10-22)12-4-8-14(9-5-12)29-21-18(25)16(23)17(24)19(30-21)20(26)27/h2-10,16-19,21,23-25H,1H3,(H,26,27)/b15-10+/t16-,17-,18+,19-,21+/m0/s1

InChIKey

QDIUCJQLPVGRDZ-BCBLFFMGSA-N

Smiles

O([C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@H](O1)C(=O)O)c1ccc(cc1)C(=C/Cl)\c1ccc(cc1)OC