Aeruginosamide 571 (CHEBI:210447)

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CHEBI:210447 - Aeruginosamide 571

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ChEBI ID	CHEBI:210447
ChEBI Name	Aeruginosamide 571
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C28H37N5O6S
Net Charge	0
Average Mass	571.700
Monoisotopic Mass	571.24645
SMILES	COC(=O)c1csc(C2CCCN2C(=O)C2CCCN2C(=O)C(NC(=O)C(N)Cc2ccc(O)cc2)C(C)C)n1
InChI	InChI=1S/C28H37N5O6S/c1-16(2)23(31-24(35)19(29)14-17-8-10-18(34)11-9-17)27(37)33-13-5-7-22(33)26(36)32-12-4-6-21(32)25-30-20(15-40-25)28(38)39-3/h8-11,15-16,19,21-23,34H,4-7,12-14,29H2,1-3H3,(H,31,35)
InChIKey	QJKMKBMIOMCHCY-UHFFFAOYSA-N

Species of Metabolite	Component	Source	Comments
Limnoraphisspecies CCNP1324 (ncbitaxon:2854020)	-	PubMed (32867236)

Roles Classification

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

ChEBI Ontology

Outgoing Relation(s)
	Aeruginosamide 571 (CHEBI:210447) is a oligopeptide (CHEBI:25676)

IUPAC Name
methyl 2-[1-[1-[2-[[2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-3-methylbutanoyl]pyrrolidine-2-carbonyl]pyrrolidin-2-yl]-1,3-thiazole-4-carboxylate