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CHEBI:228651 - GQH

ChEBI IDCHEBI:228651
ChEBI NameGQH
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H44N7O6S
Net Charge+1
Average Mass630.792
Monoisotopic Mass630.30683
SMILESCC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)N=[N+]=N)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(CN)cc1)[C@@H](O)CS(C)(=O)=O
InChIInChI=1S/C30H43N7O6S/c1-19(2)14-25(35-30(41)26(36-37-32)16-21-8-6-5-7-9-21)29(40)33-20(3)28(39)34-24(27(38)18-44(4,42)43)15-22-10-12-23(17-31)13-11-22/h5-13,19-20,24-27,32,38H,14-18,31H2,1-4H3,(H2-,33,34,35,39,40,41)/p+1/t20-,24-,25-,26-,27-/m0/s1
InChIKeyRCRPLXMWHFJRLV-KKASSDGMSA-O
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) urine (BTO:0001419) MetaboLights (MTBLS8662)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
GQH (CHEBI:228651) is a peptide (CHEBI:16670)
IUPAC Name 
[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S,3R)-1-[4-(aminomethyl)phenyl]-3-hydroxy-4-methylsulonylbutan-2-yl]amino]-1-oxopropan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]imino-iminoazanium