Curvularide A (CHEBI:200418)

EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:200418 - Curvularide A

Take structure to advanced search

ChEBI ID	CHEBI:200418
ChEBI Name	Curvularide A
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C18H35NO5
Net Charge	0
Average Mass	345.480
Monoisotopic Mass	345.25152
SMILES	CC[C@@H](O)C[C@H](C)[C@H](O)[C@](C)(O)/C=C/C(=O)N[C@H](CO)[C@@H](C)CC
InChI	InChI=1S/C18H35NO5/c1-6-12(3)15(11-20)19-16(22)8-9-18(5,24)17(23)13(4)10-14(21)7-2/h8-9,12-15,17,20-21,23-24H,6-7,10-11H2,1-5H3,(H,19,22)/b9-8+/t12-,13-,14+,15+,17-,18+/m0/s1
InChIKey	JNKVLRPMBOJUOI-WXDFVLQISA-N

Species of Metabolite	Component	Source	Comments
Curvularia geniculata (ncbitaxon:418126)	-	PubMed (20680940)

ChEBI Ontology

Outgoing Relation(s)
	Curvularide A (CHEBI:200418) is a fatty amide (CHEBI:29348)

IUPAC Name
(E,4R,5S,6S,8R)-4,5,8-trihydroxy-N-[(2S,3S)-1-hydroxy-3-methylpentan-2-yl]-4,6-dimethyldec-2-enamide

Manual Xrefs	Databases
28287981	ChemSpider