CHEBI:206654 - Fusarilactone C

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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 Fusarilactone C
ChEBI ID CHEBI:206654
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C20H32O5
Net Charge 0
Average Mass 352.471
Monoisotopic Mass 352.22497
InChI InChI=1S/C20H32O5/c1-13(9-14(2)10-15(3)11-19(22)23)7-5-6-8-17-12-18(21)16(4)20(24)25-17/h10-11,13,16-18,21H,5-9,12H2,1-4H3,(H,22,23)/b14-10+,15-11+/t13?,16-,17-,18+/m0/s1
InChIKey UJFSPDOPSFJXRP-KMJWBMAQSA-N
SMILES O=C1O[C@H](C[C@H]([C@@H]1C)O)CCCCC(C/C(=C/C(=C/C(=O)O)/C)/C)C
Metabolite of Species Details
Fusarium (NCBI:txid5506) See: PubMed
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
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ChEBI Ontology
Outgoing Fusarilactone C (CHEBI:206654) is a long-chain fatty acid (CHEBI:15904)
IUPAC Name
(2E,4E)-11-[(2S,4R,5S)-4-hydroxy-5-methyl-6-oxooxan-2-yl]-3,5,7-trimethylundeca-2,4-dienoic acid
Manual Xref Database
71360603 ChemSpider
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