Terpeptin (CHEBI:209015)

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CHEBI:209015 - Terpeptin

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ChEBI ID	CHEBI:209015
ChEBI Name	Terpeptin
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C28H40N4O3
Net Charge	0
Average Mass	480.653
Monoisotopic Mass	480.31004
SMILES	CC(=O)N[C@H](C(=O)N(C)[C@H](C(=O)N/C=C\c1c(CC=C(C)C)nc2ccccc12)C(C)C)C(C)C
InChI	InChI=1S/C28H40N4O3/c1-17(2)13-14-24-22(21-11-9-10-12-23(21)31-24)15-16-29-27(34)26(19(5)6)32(8)28(35)25(18(3)4)30-20(7)33/h9-13,15-16,18-19,25-26,31H,14H2,1-8H3,(H,29,34)(H,30,33)/b16-15-/t25-,26-/m0/s1
InChIKey	QKRDCXNLINQVQN-QXYKFECQSA-N

Species of Metabolite	Component	Source	Comments
Aspergillus (ncbitaxon:5052)	-	DOI (10.1016/s0040-4039(97)00022-1)

Roles Classification

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

ChEBI Ontology

Outgoing Relation(s)
	Terpeptin (CHEBI:209015) is a dipeptide (CHEBI:46761)

IUPAC Name
(2S)-2-acetamido-N,3-dimethyl-N-[(2S)-3-methyl-1-[[(Z)-2-[2-(3-methylbut-2-enyl)-1H-indol-3-yl]ethenyl]amino]-1-oxobutan-2-yl]butanamide

Manual Xrefs	Databases
8088713	ChemSpider