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Cethexonium bromide

PropertiesImage
MNX_IDMNXM46183 Image of MNXM46183
referencekeggD:D07737
formulaC24H50BrNO
global charge0
mol weight448.574
InChIKeyMFLMYFVIROLIRS-UHFFFAOYSA-M
InChIInChI=1S/C24H50NO.BrH/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-19-22-25(2,3)23-20-17-18-21-24(23)26;/h23-24,26H,4-22H2,1-3H3;1H/q+1;/p-1
SMILESCCCCCCCCCCCCCCCC[N+](C)(C)C1CCCCC1O.[Br-]
MNX internals
InChI (mnx)InChI=1/C24H50NO.BrH/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-19-22-25(2,3)23-20-17-18-21-24(23)26;/h23-24,26H,4-22H2,1-3H3;1H/q+1;/t23?,24?; Image of MNXM46183
SMILES (mnx)[BrH:27].[CH3:1][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:19][CH2:22][N+:25]([CH3:2])([CH3:3])[CH:23]1[CH2:20][CH2:17][CH2:18][CH2:21][CH:24]1[OH:26]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

kegg.drug:D07737
keggD:D07737
MFLMYFVIROLIRS-UHFFFAOYSA-M
Cethexonium bromide
Biocidan (TN)

keggD:M_D07737
secondary/obsolete/fantasy identifier