Ahpatinin A (CHEBI:224895)

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CHEBI:224895 - Ahpatinin A

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ChEBI ID	CHEBI:224895
ChEBI Name	Ahpatinin A
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C37H61N5O9
Net Charge	0
Average Mass	719.921
Monoisotopic Mass	719.44693
SMILES	CCCC(=O)NC(C(=O)NC(C(=O)NC(CC(C)C)C(O)CC(=O)NC(C)C(=O)NC(Cc1ccccc1)C(O)CC(=O)OC)C(C)C)C(C)C
InChI	InChI=1S/C37H61N5O9/c1-10-14-30(45)41-33(22(4)5)37(50)42-34(23(6)7)36(49)40-26(17-21(2)3)28(43)19-31(46)38-24(8)35(48)39-27(29(44)20-32(47)51-9)18-25-15-12-11-13-16-25/h11-13,15-16,21-24,26-29,33-34,43-44H,10,14,17-20H2,1-9H3,(H,38,46)(H,39,48)(H,40,49)(H,41,45)(H,42,50)
InChIKey	KNTOMIYQFLFZLR-UHFFFAOYSA-N

Species of Metabolite	Component	Source	Comments
Streptomyces (ncbitaxon:1883)	-	PubMed (3093433)

Roles Classification

Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid).

ChEBI Ontology

Outgoing Relation(s)
	Ahpatinin A (CHEBI:224895) is a peptide (CHEBI:16670)

IUPAC Name
methyl 4-[2-[[4-[[2-[[2-(butanoylamino)-3-methylbutanoyl]amino]-3-methylbutanoyl]amino]-3-hydroxy-6-methylheptanoyl]amino]propanoylamino]-3-hydroxy-5-phenylpentanoate

Manual Xrefs	Databases
78444951	ChemSpider