CHEBI:207801 - Fusarisolin A

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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 Fusarisolin A
ChEBI ID CHEBI:207801
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C21H34O5
Net Charge 0
Average Mass 366.498
Monoisotopic Mass 366.24062
InChI InChI=1S/C21H34O5/c1-14(10-15(2)11-16(3)12-19(23)24)8-6-5-7-9-17(4)20-18(13-22)21(25)26-20/h11-12,14,17-18,20,22H,5-10,13H2,1-4H3,(H,23,24)/b15-11+,16-12+/t14-,17-,18-,20-/m1/s1
InChIKey XUNUQGSQIUZPQY-NQTPPWBLSA-N
SMILES O=C1O[C@H]([C@@H](CCCCC[C@H](C/C(=C/C(=C/C(=O)O)/C)/C)C)C)[C@H]1CO
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 )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Fusarisolin A (CHEBI:207801) is a long-chain fatty acid (CHEBI:15904)
IUPAC Name
(2E,4E,7R,13R)-13-[(2R,3R)-3-(hydroxymethyl)-4-oxooxetan-2-yl]-3,5,7-trimethyltetradeca-2,4-dienoic acid
Manual Xref Database
71120863 ChemSpider
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