Tenacibactin C (CHEBI:198144)

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CHEBI:198144 - Tenacibactin C

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ChEBI ID	CHEBI:198144
ChEBI Name	Tenacibactin C
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C23H42N4O8
Net Charge	0
Average Mass	502.609
Monoisotopic Mass	502.30026
SMILES	CC(C)CC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCNC(=O)CCC(=O)O
InChI	InChI=1S/C23H42N4O8/c1-18(2)17-22(31)27(35)16-8-4-6-13-24-19(28)9-11-21(30)26(34)15-7-3-5-14-25-20(29)10-12-23(32)33/h18,34-35H,3-17H2,1-2H3,(H,24,28)(H,25,29)(H,32,33)
InChIKey	JNJGHWCLIHDZDM-UHFFFAOYSA-N

Species of Metabolite	Component	Source	Comments
Tenacibaculum (ncbitaxon:104267)	-	PubMed (17319723)

Roles Classification

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

ChEBI Ontology

Outgoing Relation(s)
	Tenacibactin C (CHEBI:198144) is a branched-chain fatty acid (CHEBI:35819)

IUPAC Name
4-[5-[hydroxy-[4-[5-[hydroxy(3-methylbutanoyl)amino]pentylamino]-4-oxobutanoyl]amino]pentylamino]-4-oxobutanoic acid

Manual Xrefs	Databases
17214511	ChemSpider