Fellutamide F (CHEBI:198337)

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CHEBI:198337 - Fellutamide F

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ChEBI ID	CHEBI:198337
ChEBI Name	Fellutamide F
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C28H53N5O8
Net Charge	0
Average Mass	587.759
Monoisotopic Mass	587.38941
SMILES	CCCCCCCCC[C@@H](O)CC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](CCC(C)C)C(O)O
InChI	InChI=1S/C28H53N5O8/c1-4-5-6-7-8-9-10-11-19(34)16-25(37)31-22(17-24(30)36)27(39)32-20(14-15-23(29)35)26(38)33-21(28(40)41)13-12-18(2)3/h18-22,28,34,40-41H,4-17H2,1-3H3,(H2,29,35)(H2,30,36)(H,31,37)(H,32,39)(H,33,38)/t19-,20+,21-,22+/m1/s1
InChIKey	ZNRBTQZHEJQSGS-MBDNFAEBSA-N

Species of Metabolite	Component	Source	Comments
Aspergillus versicolor (ncbitaxon:46472)	-	DOI (10.5012/bkcs.2011.32.10.3817)

Roles Classification

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

ChEBI Ontology

Outgoing Relation(s)
	Fellutamide F (CHEBI:198337) is a dipeptide (CHEBI:46761)

IUPAC Name
(2S)-2-[[(2S)-4-amino-2-[[(3R)-3-hydroxydodecanoyl]amino]-4-oxobutanoyl]amino]-N-[(2R)-1,1-dihydroxy-5-methylhexan-2-yl]pentanediamide

Manual Xrefs	Databases
28185061	ChemSpider