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CHEBI:31496 - dimemorfan phosphate

ChEBI IDCHEBI:31496
ChEBI Namedimemorfan phosphate
Stars
Last Modified6 March 2017
DownloadsMolfile
FormulaC18H25N.H3O4P
Net Charge0
Average Mass353.399
Monoisotopic Mass353.17560
SMILESO=P(O)(O)O.[H][C@]12CCCC[C@@]13CCN(C)[C@@H]2Cc1ccc(C)cc13
InChIInChI=1S/C18H25N.H3O4P/c1-13-6-7-14-12-17-15-5-3-4-8-18(15,16(14)11-13)9-10-19(17)2;1-5(2,3)4/h6-7,11,15,17H,3-5,8-10,12H2,1-2H3;(H3,1,2,3,4)/t15-,17-,18-;/m1./s1
InChIKeyODJHDWLIOUGPPA-GUCVWDHMSA-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)
dimemorfan phosphate (CHEBI:31496) is a alkaloid phosphate (CHEBI:37506)
dimemorfan phosphate (CHEBI:31496) is a isoquinoline alkaloid (CHEBI:24921)
dimemorfan phosphate (CHEBI:31496) is a organoammonium phosphate (CHEBI:37509)
Synonym  Source
Dimemorfan phosphateKEGG COMPOUND
Manual XrefsDatabases
D01506KEGG DRUG
Registry NumbersSources
CAS:36304-84-4KEGG COMPOUND