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CHEBI:204022 - Muscarinic receptor antagonist 1

ChEBI IDCHEBI:204022
ChEBI NameMuscarinic receptor antagonist 1
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H33N7O
Net Charge0
Average Mass327.477
Monoisotopic Mass327.27466
SMILESNC(N)=NCCCCCCCCC(=O)[C@@H](N)CCCN=C(N)N
InChIInChI=1S/C15H33N7O/c16-12(8-7-11-22-15(19)20)13(23)9-5-3-1-2-4-6-10-21-14(17)18/h12H,1-11,16H2,(H4,17,18,21)(H4,19,20,22)/t12-/m0/s1
InChIKeyYLKMPCDZOHNNJU-LBPRGKRZSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - DOI (10.1021/np50120a004)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Muscarinic receptor antagonist 1 (CHEBI:204022) is a ketone (CHEBI:17087)
Muscarinic receptor antagonist 1 (CHEBI:204022) is a organic amino compound (CHEBI:50047)
IUPAC Name 
2-[4-amino-13-(diaminomethylideneamino)-5-oxotridecyl]guanidine
Manual XrefsDatabases
24698816ChemSpider