Asperlide (CHEBI:204551)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	Asperlide

ChEBI ID	CHEBI:204551

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C20H20O7

Net Charge

Average Mass

372.373

Monoisotopic Mass

372.12090

InChI

InChI=1S/C20H20O7/c1-5-20(4)12-8-14(10(3)17(23)16(12)19(25)27-20)26-18(24)15-9(2)6-11(21)7-13(15)22/h6-8,21-23H,5H2,1-4H3/t20-/m0/s1

InChIKey

GZOHFFLUJQDNFV-FQEVSTJZSA-N

SMILES

O=C1O[C@](CC)(C)C=2C1=C(O)C(=C(OC(=O)C3=C(O)C=C(O)C=C3C)C2)C

Metabolite of Species	Details
Aspergillus (NCBI:txid5052)	See: DOI

Roles Classification
Chemical Role(s):	Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid )

ChEBI Ontology
Outgoing	Asperlide (CHEBI:204551) is a hydroxybenzoic acid (CHEBI:24676)

IUPAC Name

[(3S)-3-ethyl-7-hydroxy-3,6-dimethyl-1-oxo-2-benzouran-5-yl] 2,4-dihydroxy-6-methylbenzoate