Campafungin D (CHEBI:224804)

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CHEBI:224804 - Campafungin D

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ChEBI ID	CHEBI:224804
ChEBI Name	Campafungin D
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C24H30O4
Net Charge	0
Average Mass	382.500
Monoisotopic Mass	382.21441
SMILES	C/C=C(\C)[C@]1(O)C=C[C@@H]2CC(C)=CC[C@H]2[C@]1(O)/C=C/C=C\C=C\C=C\C(=O)O
InChI	InChI=1S/C24H30O4/c1-4-19(3)23(27)16-14-20-17-18(2)12-13-21(20)24(23,28)15-10-8-6-5-7-9-11-22(25)26/h4-12,14-16,20-21,27-28H,13,17H2,1-3H3,(H,25,26)/b7-5+,8-6-,11-9+,15-10+,19-4+/t20-,21-,23-,24-/m1/s1
InChIKey	WUNXOGJUDRVVDA-PPEXVTMASA-N

Species of Metabolite	Component	Source	Comments
Plenodomus enteroleucus (ncbitaxon:1077365)	-	PubMed (32881504)

Roles Classification

Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base).

ChEBI Ontology

Outgoing Relation(s)
	Campafungin D (CHEBI:224804) is a medium-chain fatty acid (CHEBI:59554)

IUPAC Name
(2E,4E,6Z,8E)-9-[(1R,2R,4aS,8aR)-2-[(E)-but-2-en-2-yl]-1,2-dihydroxy-6-methyl-4a,5,8,8a-tetrahydronaphthalen-1-yl]nona-2,4,6,8-tetraenoic acid