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CHEBI:31436 - Crinamidine

ChEBI IDCHEBI:31436
ChEBI NameCrinamidine
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC17H19NO5
Net Charge0
Average Mass317.341
Monoisotopic Mass317.12632
SMILES[H][C@@]12C[C@@H](O)[C@@H]3O[C@@H]3[C@]13CC[N@@]2Cc1c3cc2c(c1OC)OCO2
InChIInChI=1S/C17H19NO5/c1-20-13-8-6-18-3-2-17(9(8)4-11-15(13)22-7-21-11)12(18)5-10(19)14-16(17)23-14/h4,10,12,14,16,19H,2-3,5-7H2,1H3/t10-,12-,14+,16+,17+/m1/s1
InChIKeyHHEOZJCKMANJQV-CUQLUGJVSA-N
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
Crinamidine (CHEBI:31436) is a alkaloid (CHEBI:22315)
Synonym  Source
CrinamidineKEGG COMPOUND
Manual XrefsDatabases
C00024382KNApSAcK
C12168KEGG COMPOUND