Microtermolide B (CHEBI:222703)

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CHEBI:222703 - Microtermolide B

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ChEBI ID	CHEBI:222703
ChEBI Name	Microtermolide B
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C22H35N3O7
Net Charge	0
Average Mass	453.536
Monoisotopic Mass	453.24750
SMILES	CCC[C@@H](C)[C@@H](OC(=O)[C@H](NC(=O)[C@H](C)NC(=O)/C=C/C(N)=O)C(C)C)[C@H]1CCOC1=O
InChI	InChI=1S/C22H35N3O7/c1-6-7-13(4)19(15-10-11-31-21(15)29)32-22(30)18(12(2)3)25-20(28)14(5)24-17(27)9-8-16(23)26/h8-9,12-15,18-19H,6-7,10-11H2,1-5H3,(H2,23,26)(H,24,27)(H,25,28)/b9-8+/t13-,14+,15-,18-,19-/m1/s1
InChIKey	KFOVZWSWKKYISY-IFXYZXERSA-N

Species of Metabolite	Component	Source	Comments
Streptomycesspecies (ncbitaxon:1931)	-	PubMed (22591554)

Roles Classification

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

ChEBI Ontology

Outgoing Relation(s)
	Microtermolide B (CHEBI:222703) is a peptide (CHEBI:16670)

IUPAC Name
[(1R,2R)-2-methyl-1-[(3R)-2-oxooxolan-3-yl]pentyl] (2R)-2-[[(2S)-2-[[(E)-4-amino-4-oxobut-2-enoyl]amino]propanoyl]amino]-3-methylbutanoate