Aeruginosamide 693 (CHEBI:210471)

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CHEBI:210471 - Aeruginosamide 693

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ChEBI ID	CHEBI:210471
ChEBI Name	Aeruginosamide 693
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C36H51N5O6S
Net Charge	0
Average Mass	681.900
Monoisotopic Mass	681.35601
SMILES	C=CC(C)(C)N(C(Cc1ccc(O)cc1)C(=O)NC(C(=O)N1CCCC1C(=O)N1CCCC1c1nc(C(=O)O)cs1)C(C)C)C(C)(C)C
InChI	InChI=1S/C36H51N5O6S/c1-9-36(7,8)41(35(4,5)6)28(20-23-14-16-24(42)17-15-23)30(43)38-29(22(2)3)33(45)40-19-11-13-27(40)32(44)39-18-10-12-26(39)31-37-25(21-48-31)34(46)47/h9,14-17,21-22,26-29,42H,1,10-13,18-20H2,2-8H3,(H,38,43)(H,46,47)
InChIKey	OIUDOESTZZFCMT-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 693 (CHEBI:210471) is a oligopeptide (CHEBI:25676)

IUPAC Name
2-[1-[1-[2-[[2-[tert-butyl(2-methylbut-3-en-2-yl)amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-methylbutanoyl]pyrrolidine-2-carbonyl]pyrrolidin-2-yl]-1,3-thiazole-4-carboxylic acid