
API0231737
Demecarium Bromide
Demecarium Bromide is used for glaucoma.
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CAS No.
56-94-0
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Synonyms
DEMECARIUM BROMIDE; 56-94-0; Humorsol
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CHEMBL ID
CHEMBL1200514
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Indications
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Molecule Type
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Compound CID
5965
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Molecular Weight (g/mol)
716.6
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Molecular Formula
C32H52Br2N4O4
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InChI
InChI=1S/C32H52N4O4.2BrH/c1-33(31(37)39-29-21-17-19-27(25-29)35(3,4)5)23-15-13-11-9-10-12-14-16-24-34(2)32(38)40-30-22-18-20-28(26-30)36(6,7)8;;/h17-22,25-26H,9-16,23-24H2,1-8H3;2*1H/q+2;;/p-2
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InChIKey
YHKBUDZECQDYBR-UHFFFAOYSA-L
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SMILES
CN(CCCCCCCCCCN(C)C(=O)OC1=CC=CC(=C1)[N+](C)(C)C)C(=O)OC2=CC=CC(=C2)[N+](C)(C)C.[Br-].[Br-]
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IUPAC Name
trimethyl-[3-[methyl-[10-[methyl-[3-(trimethylazaniumyl)phenoxy]carbonylamino]decyl]carbamoyl]oxyphenyl]azanium;dibromide
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Exact Mass (Da)
716.23348
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Monoisotopic Mass (Da)
714.23553
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