Ceriporic acid B (CHEBI:184466)

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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	Ceriporic acid B

ChEBI ID	CHEBI:184466

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C21H38O4

Net Charge

Average Mass

354.531

Monoisotopic Mass

354.27701

InChI

InChI=1S/C21H38O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19(21(24)25)18(2)20(22)23/h19H,2-17H2,1H3,(H,22,23)(H,24,25)/t19-/m1/s1

InChIKey

GFBJXFMJWQHQJC-LJQANCHMSA-N

SMILES

OC(=O)[C@H](CCCCCCCCCCCCCCCC)C(C(O)=O)=C

Metabolite of Species	Details
Mus musculus (NCBI:txid10090)	Found in feces (BTO:0000440). of strain C57BL/6 Mouse [NCIT:C14424] See: MetaboLights Study

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	Ceriporic acid B (CHEBI:184466) is a long-chain fatty acid (CHEBI:15904)

IUPAC Name

(2R)-2-hexadecyl-3-methylidenebutanedioic acid