Triticone A (CHEBI:222587)

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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	Triticone A

ChEBI ID	CHEBI:222587

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C14H15NO5

Net Charge

Average Mass

277.276

Monoisotopic Mass

277.09502

InChI

InChI=1S/C14H15NO5/c1-4-5-9-6-7-10(16)12(18)14(9)11(17)8(2)15(20-3)13(14)19/h5-7,12,18H,2,4H2,1,3H3/b9-5-/t12-,14?/m1/s1

InChIKey

UVGXMQSQHURGBS-QPSWRTKESA-N

SMILES

O=C1C=C/C(=C/CC)/C2([C@@H]1O)C(=O)N(OC)C(C2=O)=C

Metabolite of Species	Details
Pyrenophora tritici-repentis (NCBI:txid45151)	See: DOI

ChEBI Ontology
Outgoing	Triticone A (CHEBI:222587) is a cyclohexenones (CHEBI:48953)

IUPAC Name

(6Z,10S)-10-hydroxy-2-methoxy-3-methylidene-6-propylidene-2-azaspiro[4.5]dec-7-ene-1,4,9-trione