Structure via PubChem · Public domain (PubChem)
isochorismic acid
Sign in to saveAlso known as (5S,6S)-5-[(1-carboxyethenyl)oxy]-6-hydroxycyclohexa-1,3-diene-1-carboxylic acid
chemical compound
In the Vinony graph
Within Vinony's link graph, isochorismic acid is referenced by 7 other articles, and connects out to International Standard Book Number, acid and mass density.
It is catalogued under topics including Benzoic acids, Chembox image size set and Chemical articles with multiple ChEBIs.
Its subject is documented across 5 Wikipedia language editions.
Chemical data
- Formula
- C10H10O6
- Molecular weight
- 226.18 g/mol
- IUPAC name
- (5S,6S)-5-(1-carboxyethenoxy)-6-hydroxycyclohexa-1,3-diene-1-carboxylic acid
- SMILES
- C=C(C(=O)O)O[C@H]1C=CC=C([C@@H]1O)C(=O)O
- InChIKey
- NTGWPRCCOQCMGE-YUMQZZPRSA-N
- XLogP
- 0.8
- Polar surface area
- 104 Ų
- H-bond donors
- 3
- H-bond acceptors
- 6
- Formal charge
- 0
via PubChem
Wikidata facts
- Mass
- 226.048
Show 5 more facts
- chemical formula
- C₁₀H₁₀O₆
- canonical SMILES
- C=C(C(=O)O)OC1C=CC=C(C1O)C(=O)O
- subject has role
- primary metabolite
- isomeric SMILES
- C=C(C(=O)O)O[C@H]1C=CC=C([C@@H]1O)C(=O)O
- found in taxon
- Catharanthus roseus
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