Gallinamide A (CHEBI:219302)

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CHEBI:219302 - Gallinamide A

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ChEBI ID	CHEBI:219302
ChEBI Name	Gallinamide A
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C31H52N4O7
Net Charge	0
Average Mass	592.778
Monoisotopic Mass	592.38360
SMILES	CC[C@H](C)[C@@H](C(=O)O[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)/C=C/C(=O)N1C(=O)C=C(OC)[C@@H]1C)N(C)C
InChI	InChI=1S/C31H52N4O7/c1-12-20(6)28(34(9)10)31(40)42-25(16-19(4)5)30(39)33-23(15-18(2)3)29(38)32-21(7)13-14-26(36)35-22(8)24(41-11)17-27(35)37/h13-14,17-23,25,28H,12,15-16H2,1-11H3,(H,32,38)(H,33,39)/b14-13+/t20-,21-,22-,23-,25-,28-/m0/s1
InChIKey	ASRBKZHDORPEHO-KYJIWOQOSA-N

Species of Metabolite	Component	Source	Comments
Schizothrix (ncbitaxon:240294)	-	PubMed (19161344)

Roles Classification

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

ChEBI Ontology

Outgoing Relation(s)
	Gallinamide A (CHEBI:219302) is a depsipeptide (CHEBI:23643)

IUPAC Name
[(2S)-1-[[(2S)-1-[[(E,2S)-5-[(2S)-3-methoxy-2-methyl-5-oxo-2H-pyrrol-1-yl]-5-oxopent-3-en-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl] (2S,3S)-2-(dimethylamino)-3-methylpentanoate

Manual Xrefs	Databases
24614023	ChemSpider