2,3 -ANHYDRO-QUINIC ACID (CHEBI:42379)

CHEBI:42379 - 2,3 -ANHYDRO-QUINIC ACID

Formula	C7H10O5
Net Charge	0
Average Mass	174.152
Monoisotopic Mass	174.05282
SMILES	[H]OC(=O)[C@]1(O[H])C([H])=C([H])[C@@]([H])(O[H])[C@]([H])(O[H])C1([H])[H]
InChI	InChI=1S/C7H10O5/c8-4-1-2-7(12,6(10)11)3-5(4)9/h1-2,4-5,8-9,12H,3H2,(H,10,11)/t4-,5-,7+/m1/s1
InChIKey	VTEDVYGIJPLVFF-XAHCXIQSSA-N

ChEBI Ontology

Outgoing Relation(s)
	2,3 -ANHYDRO-QUINIC ACID (CHEBI:42379) is a unclassifieds (CHEBI:27189)

Synonyms	Source
(1R,4R,5R)-1,4,5-trihydroxycyclohex-2-ene-1-carboxylic acid	PDBeChem
2,3 -ANHYDRO-QUINIC ACID	PDBeChem

Manual Xrefs	Databases
FA1	PDBeChem