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CHEBI:200707 - GE81112

ChEBI IDCHEBI:200707
ChEBI NameGE81112
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC24H35ClN10O10
Net Charge0
Average Mass659.057
Monoisotopic Mass658.22262
SMILESNC(=O)OCC(O)CC(NC(=O)C1NCCCC1O)C(=O)NC(Cc1cnc(N)n1)C(=O)NC(C(=O)O)C(O)c1ncc(Cl)n1
InChIInChI=1S/C24H35ClN10O10/c25-14-7-29-18(34-14)17(38)16(22(42)43)35-20(40)11(4-9-6-30-23(26)31-9)32-19(39)12(5-10(36)8-45-24(27)44)33-21(41)15-13(37)2-1-3-28-15/h6-7,10-13,15-17,28,36-38H,1-5,8H2,(H2,27,44)(H,29,34)(H,32,39)(H,33,41)(H,35,40)(H,42,43)(H3,26,30,31)
InChIKeyXUPLSXHPJUYVNP-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Streptomycesspecies (ncbitaxon:1931) - PubMed (16380421)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
GE81112 (CHEBI:200707) is a oligopeptide (CHEBI:25676)
IUPAC Name 
2-[[3-(2-amino-1H-imidazol-5-yl)-2-[[5-carbamoyloxy-4-hydroxy-2-[(3-hydroxypiperidine-2-carbonyl)amino]pentanoyl]amino]propanoyl]amino]-3-(5-chloro-1H-imidazol-2-yl)-3-hydroxypropanoic acid
Manual XrefsDatabases
9753104ChemSpider