Microginin 580 (CHEBI:222325)

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CHEBI:222325 - Microginin 580

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ChEBI ID	CHEBI:222325
ChEBI Name	Microginin 580
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C29H48N4O8
Net Charge	0
Average Mass	580.723
Monoisotopic Mass	580.34721
SMILES	CCCCCCCC(N)C(O)C(=O)NC(CO)C(=O)N(C)C(CC(C)C)C(=O)NC(Cc1ccc(O)cc1)C(=O)O
InChI	InChI=1S/C29H48N4O8/c1-5-6-7-8-9-10-21(30)25(36)27(38)32-23(17-34)28(39)33(4)24(15-18(2)3)26(37)31-22(29(40)41)16-19-11-13-20(35)14-12-19/h11-14,18,21-25,34-36H,5-10,15-17,30H2,1-4H3,(H,31,37)(H,32,38)(H,40,41)
InChIKey	FRLFHRFBQODDEQ-UHFFFAOYSA-N

Roles Classification

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

ChEBI Ontology

Outgoing Relation(s)
	Microginin 580 (CHEBI:222325) is a peptide (CHEBI:16670)

IUPAC Name
2-[[2-[[2-[(3-amino-2-hydroxydecanoyl)amino]-3-hydroxypropanoyl]-methylamino]-4-methylpentanoyl]amino]-3-(4-hydroxyphenyl)propanoic acid