7-methylmellein (CHEBI:192524)

ChEBI > Main

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name	7-methylmellein

ChEBI ID	CHEBI:192524

Definition	An isochromane that is mellein bearing an additional methyl substituent at position 7.

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

Submitter	Anne Morgat

Supplier Information

Download	Molfile XML SDF

Formula

C11H12O3

Net Charge

Average Mass

192.214

Monoisotopic Mass

192.07864

InChI

InChI=1S/C11H12O3/c1-6-3-4-8-5-7(2)14-11(13)9(8)10(6)12/h3-4,7,12H,5H2,1-2H3

InChIKey

SLYRNFYMGDTQEZ-UHFFFAOYSA-N

SMILES

CC1CC2=CC=C(C)C(O)=C2C(=O)O1

Metabolite of Species	Details
Camponotus rufipes (NCBI:txid105048)	See: DOI
Camponotus silvicola (NCBI:txid105053)	See: DOI

Roles Classification
Biological Role(s):	insect attractant A chemical that attracts insects. Aspergillus metabolite Any fungal metabolite produced during a metabolic reaction in the mould, Aspergillus . pheromone A semiochemical used in olfactory communication between organisms of the same species eliciting a change in sexual or social behaviour. animal metabolite Any eukaryotic metabolite produced during a metabolic reaction in animals that include diverse creatures from sponges, insects to mammals.

ChEBI Ontology
Outgoing	7-methylmellein (CHEBI:192524) has functional parent mellein (CHEBI:38760) 7-methylmellein (CHEBI:192524) has role Aspergillus metabolite (CHEBI:76956) 7-methylmellein (CHEBI:192524) has role animal metabolite (CHEBI:75767) 7-methylmellein (CHEBI:192524) has role insect attractant (CHEBI:24850) 7-methylmellein (CHEBI:192524) has role pheromone (CHEBI:26013) 7-methylmellein (CHEBI:192524) is a isochromanes (CHEBI:38762)

IUPAC Name

8-hydroxy-3,7-dimethyl-3,4-dihydro-1H-isochromen-1-one

Synonyms	Sources
3,4-dihydro-8-hydroxy-3,7-dimethylisocoumarin	ChEBI
7-methylmellein	UniProt
7-MM	SUBMITTER
8-hydroxy-3,7-dimethyl-3,4-dihydro-1H-2-benzopyran-1-one	IUPAC
8-hydroxy-3,7-dimethyl-3,4-dihydroisochromen-1-one	SUBMITTER

Registry Number	Type	Source
1799965-79-9	CAS Registry Number	ChEBI

Last Modified

06 July 2022