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CHEBI:749372 - diphenhydramine citrate

Default Structure
ChEBI IDCHEBI:749372
ChEBI Namediphenhydramine citrate
Stars
Last Modified29 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC17H21NO.C6H8O7
Net Charge0
Average Mass447.484
Monoisotopic Mass447.18932
SMILESCN(C)CCOC(c1ccccc1)c1ccccc1.O=C(O)CC(O)(CC(=O)O)C(=O)O
InChIInChI=1S/C17H21NO.C6H8O7/c1-18(2)13-14-19-17(15-9-5-3-6-10-15)16-11-7-4-8-12-16;7-3(8)1-6(13,5(11)12)2-4(9)10/h3-12,17H,13-14H2,1-2H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)
InChIKeySPCKHVPPRJWQRZ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
diphenhydramine citrate (CHEBI:749372) is a diarylmethane (CHEBI:51614)