Fusariumindole C (CHEBI:225314)

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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	Fusariumindole C

ChEBI ID	CHEBI:225314

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C18H15NO4

Net Charge

Average Mass

309.321

Monoisotopic Mass

309.10011

InChI

InChI=1S/C18H15NO4/c20-17(21)16(10-12-6-2-1-3-7-12)23-18(22)14-11-19-15-9-5-4-8-13(14)15/h1-9,11,16,19H,10H2,(H,20,21)/t16-/m1/s1

InChIKey

PYVNEMHBMYTTIY-MRXNPFEDSA-N

SMILES

O=C(O[C@@H](C(=O)O)CC1=CC=CC=C1)C=2C3=C(C=CC=C3)NC2

Metabolite of Species	Details
Fusariumspecies L1 (NCBI:txid1849704)	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	Fusariumindole C (CHEBI:225314) is a indolyl carboxylic acid (CHEBI:46867)

IUPAC Name

(2R)-2-(1H-indole-3-carbonyloxy)-3-phenylpropanoic acid