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CHEBI:230274 - Acrip

ChEBI IDCHEBI:230274
ChEBI NameAcrip
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC57H80N12O9
Net Charge0
Average Mass1077.342
Monoisotopic Mass1076.61712
SMILESCC(C)CC(=O)NC(Cc1cncn1)C(=O)N1CCCC1C(=O)NC(Cc1ccccc1)C(=O)NC(Cc1nccn1)C(=O)NC(CC1CCCCC1)C(O)CC(=O)NC(CC(C)C)C(=O)NC(Cc1ccccc1)C(N)=O
InChIInChI=1S/C57H80N12O9/c1-35(2)25-43(53(74)66-42(52(58)73)28-38-17-10-6-11-18-38)63-51(72)32-48(70)41(27-37-15-8-5-9-16-37)65-55(76)45(31-49-60-22-23-61-49)67-54(75)44(29-39-19-12-7-13-20-39)68-56(77)47-21-14-24-69(47)57(78)46(30-40-33-59-34-62-40)64-50(71)26-36(3)4/h6-7,10-13,17-20,22-23,33-37,41-48,70H,5,8-9,14-16,21,24-32H2,1-4H3,(H2,58,73)(H,59,62)(H,60,61)(H,63,72)(H,64,71)(H,65,76)(H,66,74)(H,67,75)(H,68,77)
InChIKeyRJAVXZVSWBQSPN-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS9100)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Acrip (CHEBI:230274) is a peptide (CHEBI:16670)
IUPAC Name 
N-[1-[[1-[[5-[[1-[(1-amino-1-oxo-3-phenylpropan-2-yl)amino]-4-methyl-1-oxopentan-2-yl]amino]-1-cyclohexyl-3-hydroxy-5-oxopentan-2-yl]amino]-3-(1H-imidazol-2-yl)-1-oxopropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]-1-[3-(1H-imidazol-5-yl)-2-(3-methylbutanoylamino)propanoyl]pyrrolidine-2-carboxamide
Manual XrefsDatabases
HMDB0247970HMDB
143549ChemSpider