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Substance Name: Isochorismic acid
RN: 22642-82-6
InChIKey: NTGWPRCCOQCMGE-YUMQZZPRSA-N

Molecular Weight

  • 226.183
 
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Names and Synonyms

Name of Substance

  • Isochorismic acid

Synonyms

  • 5-((1-Carboxyethenyl)oxy)-6-hydroxy-1,3-cyclohexadiene-1-carboxylic acid
  • Iso-chorismic acid
  • Isochorismate

Systematic Name

  • 1,3-Cyclohexadiene-1-carboxylic acid, 5-((1-carboxyethenyl)oxy)-6-hydroxy-, trans-

Registry Numbers

CAS Registry Number

  • 22642-82-6

System Generated Number

  • 0022642826

Structure Descriptors

InChI

1S/C10H10O6/c1-5(9(12)13)16-7-4-2-3-6(8(7)11)10(14)15/h2-4,7-8,11H,1H2,(H,12,13)(H,14,15)/t7-,8-/m0/s1

InChIKey

NTGWPRCCOQCMGE-YUMQZZPRSA-N

Smiles

C1(=CC=C[C@@H]([C@H]1O)OC(=C)C(=O)O)C(=O)O