(E)-lowdenic acid (CHEBI:197913)

EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:197913 - (E)-lowdenic acid

Take structure to advanced search

ChEBI ID	CHEBI:197913
ChEBI Name	(E)-lowdenic acid
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C26H40O6
Net Charge	0
Average Mass	448.600
Monoisotopic Mass	448.28249
SMILES	CCCCCCCCCC[C@H](C)CCC[C@]1(C)C=C/C(=C2\C(=O)O[C@@H](CC(=O)O)C2=O)O1
InChI	InChI=1S/C26H40O6/c1-4-5-6-7-8-9-10-11-13-19(2)14-12-16-26(3)17-15-20(32-26)23-24(29)21(18-22(27)28)31-25(23)30/h15,17,19,21H,4-14,16,18H2,1-3H3,(H,27,28)/b23-20+/t19-,21-,26+/m0/s1
InChIKey	GTHQWTZYJQZCCN-JTXPKECXSA-N

Species of Metabolite	Component	Source	Comments
Verticillium (ncbitaxon:1036719)	-	PubMed (14510612)

ChEBI Ontology

Outgoing Relation(s)
	(E)-lowdenic acid (CHEBI:197913) is a γ-lactone (CHEBI:37581)

IUPAC Name
2-[(2S,4E)-4-[(5R)-5-methyl-5-[(4S)-4-methyltetradecyl]uran-2-ylidene]-3,5-dioxooxolan-2-yl]acetic acid

Manual Xrefs	Databases
78439987	ChemSpider