Concept information
Preferred term
(1S,6R) 2 (3 carboxylatopropanoyl) 6 hydroxycyclohexa 2,4 diene 1 carboxylate(2)
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- -2
formula
- C11H10O6
inchi
- InChI=1S/C11H12O6/c12-7(4-5-9(14)15)6-2-1-3-8(13)10(6)11(16)17/h1-3,8,10,13H,4-5H2,(H,14,15)(H,16,17)/p-2/t8-,10+/m1/s1
inchikey
- QJYRAJSESKVEAE-SCZZXKLOSA-L
is_conjugate_base_of
mass
- 238.19350
monoisotopicmass
- 238.04774
smiles
- O[C@@H]1C=CC=C([C@@H]1C([O-])=O)C(=O)CCC([O-])=O
subset
- 3_STAR
synonym EXACT
- (1S,6R)-2-(3-carboxylatopropanoyl)-6-hydroxycyclohexa-2,4-diene-1-carboxylate
In other languages
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:57272
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