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Substance Name: beta-D-Glucopyranosiduronic acid, 1-(2,2-dimethyl-3-(2-methyl-3-oxo-1-propenyl)cyclopropanecarboxylate), (1R-trans)-
RN: 93040-27-8
InChIKey: IHMZOFXBSJFAFB-HEABAQGESA-N

Molecular Weight

  • 358.341
 
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Names and Synonyms

  • beta-D-Glucopyranosiduronic acid, 1-(2,2-dimethyl-3-(2-methyl-3-oxo-1-propenyl)cyclopropanecarboxylate), (1R-trans)-

Registry Numbers

CAS Registry Number

  • 93040-27-8

Other Registry Number

  • 95839-57-9

System Generated Number

  • 0093040278

Structure Descriptors

InChI

1S/C16H22O9/c1-6(5-17)4-7-8(16(7,2)3)14(23)25-15-11(20)9(18)10(19)12(24-15)13(21)22/h4-5,7-12,15,18-20H,1-3H3,(H,21,22)/b6-4+/t7-,8+,9+,10+,11-,12+,15-/m1/s1

InChIKey

IHMZOFXBSJFAFB-HEABAQGESA-N

Smiles

O[C@H]1[C@H](O[C@@H]([C@H]([C@@H]1O)O)C(=O)O)OC(=O)[C@H]1C([C@@H]1\C=C(\C=O)C)(C)C