(-)-12-Methoxy-2,3-dihydrocitromycetin (CHEBI:199791)

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

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	(-)-12-Methoxy-2,3-dihydrocitromycetin

ChEBI ID	CHEBI:199791

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C15H14O7

Net Charge

Average Mass

306.270

Monoisotopic Mass

306.07395

InChI

InChI=1S/C15H14O7/c1-6-3-8(16)7-5-21-10-4-9(17)14(20-2)12(15(18)19)11(10)13(7)22-6/h4,6,17H,3,5H2,1-2H3,(H,18,19)/t6-/m1/s1

InChIKey

ZXGSOJZTAIDGMW-ZCFIWIBFSA-N

SMILES

O=C1C2=C(O[C@@H](C1)C)C3=C(C(OC)=C(O)C=C3OC2)C(=O)O

Metabolite of Species	Details
Penicillium (NCBI:txid5073)	See: PubMed

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	(-)-12-Methoxy-2,3-dihydrocitromycetin (CHEBI:199791) is a methoxybenzoic acid (CHEBI:25238)

IUPAC Name

(2R)-8-hydroxy-9-methoxy-2-methyl-4-oxo-3,5-dihydro-2H-pyrano[3,2-c]chromene-10-carboxylic acid