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CHEBI:226328 - Trichopeptide B

ChEBI IDCHEBI:226328
ChEBI NameTrichopeptide B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H31N3O6
Net Charge0
Average Mass421.494
Monoisotopic Mass421.22129
SMILESCC(C)C[C@@H](C(=O)O)N(C)C(=O)[C@@H](C)NC(=O)[C@H](CCO)NC(=O)c1ccccc1
InChIInChI=1S/C21H31N3O6/c1-13(2)12-17(21(29)30)24(4)20(28)14(3)22-19(27)16(10-11-25)23-18(26)15-8-6-5-7-9-15/h5-9,13-14,16-17,25H,10-12H2,1-4H3,(H,22,27)(H,23,26)(H,29,30)/t14-,16+,17+/m1/s1
InChIKeyDFBHYMPZDWKEGR-PVAVHDDUSA-N
Species of MetaboliteComponentSourceComments
Stagonospora trichophoricola (ncbitaxon:1508255) - PubMed (28676717)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Trichopeptide B (CHEBI:226328) is a peptide (CHEBI:16670)
IUPAC Name 
(2S)-2-[[(2R)-2-[[(2S)-2-benzamido-4-hydroxybutanoyl]amino]propanoyl]-methylamino]-4-methylpentanoic acid
Manual XrefsDatabases
78438816ChemSpider