Iheyamide C (CHEBI:224197)

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CHEBI:224197 - Iheyamide C

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ChEBI ID	CHEBI:224197
ChEBI Name	Iheyamide C
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C38H55N5O6
Net Charge	0
Average Mass	677.887
Monoisotopic Mass	677.41523
SMILES	CCC(C)[C@@H](C(=O)O)N(C)C(=O)[C@@H]1CCCN1C(=O)[C@H](C(C)C)N(C)C(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)N(C)C
InChI	InChI=1S/C38H55N5O6/c1-9-26(4)33(38(48)49)42(8)36(46)30-21-16-22-43(30)37(47)32(25(2)3)41(7)35(45)29(23-27-17-12-10-13-18-27)39-34(44)31(40(5)6)24-28-19-14-11-15-20-28/h10-15,17-20,25-26,29-33H,9,16,21-24H2,1-8H3,(H,39,44)(H,48,49)/t26?,29-,30+,31+,32+,33+/m1/s1
InChIKey	MFLOERPGEKLIJM-OGCSBCMNSA-N

Species of Metabolite	Component	Source	Comments
Dapis (ncbitaxon:2302373)	-	PubMed (32352773)

Roles Classification

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

ChEBI Ontology

Outgoing Relation(s)
	Iheyamide C (CHEBI:224197) is a peptide (CHEBI:16670)

IUPAC Name
(2S)-2-[[(2S)-1-[(2S)-2-[[(2R)-2-[[(2S)-2-(dimethylamino)-3-phenylpropanoyl]amino]-3-phenylpropanoyl]-methylamino]-3-methylbutanoyl]pyrrolidine-2-carbonyl]-methylamino]-3-methylpentanoic acid