methyltetrahydrophthalic anhydride (CHEBI:55466)

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ChEBI Name	methyltetrahydrophthalic anhydride

ChEBI ID	CHEBI:55466

Definition	A cyclic dicarboxylic anhydride that is the cyclic anhydride of methyltetrahydrophthalic acid.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

Download	Molfile XML SDF

Formula

C9H10O3

Net Charge

Average Mass

166.17390

Monoisotopic Mass

166.06299

InChI

InChI=1S/C9H10O3/c1-9-5-3-2-4-6(9)7(10)12-8(9)11/h2-3,6H,4-5H2,1H3

InChIKey

SOOZEQGBHHIHEF-UHFFFAOYSA-N

SMILES

CC12CC=CCC1C(=O)OC2=O

Roles Classification
Biological Role(s):	allergen A chemical compound, or part thereof, which causes the onset of an allergic reaction by interacting with any of the molecular pathways involved in an allergy.

ChEBI Ontology
Outgoing	methyltetrahydrophthalic anhydride (CHEBI:55466) has role allergen (CHEBI:50904) methyltetrahydrophthalic anhydride (CHEBI:55466) is a cyclic dicarboxylic anhydride (CHEBI:36609) methyltetrahydrophthalic anhydride (CHEBI:55466) is a tetrahydrofurandione (CHEBI:47022)

IUPAC Name

3a-methyl-3a,4,7,7a-tetrahydro-2-benzofuran-1,3-dione

Synonyms	Sources
1,2,3,6-Tetrahydromethylphthalic anhydride	ChemIDplus
1-methylcyclohex-4-ene-1,2-dicarboxylic acid anhydride	ChEBI
3a,4,7,7a-tetrahydromethyl-1,3-isobenzofurandione	ChemIDplus
Methyl tetrahydrophthalic anhydride	ChemIDplus
MTHPA	ChEBI

Last Modified

15 March 2016