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(Q72497987)
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English
Orphenadrine citrate
chemical compound
Norflex
N,N-Dimethyl-2-[(2-methylphenyl)-phenylmethoxy]ethanamine 2-hydroxypropane-1,2,3-tricarboxylic acid salt
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
chemical formula
C₂₄H₃₁NO₈
0 references
canonical SMILES
Cc1ccccc1C(OCCN(C)C)c1ccccc1.O=C(O)CC(O)(CC(=O)O)C(=O)O
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C18H23NO.C6H8O7/c1-15-9-7-8-12-17(15)18(20-14-13-19(2)3)16-10-5-4-6-11-16;7-3(8)1-6(13,5(11)12)2-4(9)10/h4-12,18H,13-14H2,1-3H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)
0 references
InChIKey
MMMNTDFSPSQXJP-UHFFFAOYSA-N
1 reference
based on heuristic
inferred from InChI
CAS Registry Number
4596-23-0
0 references
PubChem CID
20846
1 reference
matched by identifier from
InChIKey
InChIKey
MMMNTDFSPSQXJP-UHFFFAOYSA-N
83823
1 reference
matched by identifier from
InChIKey
InChIKey
MMMNTDFSPSQXJP-UHFFFAOYSA-N
ChEBI ID
7790
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C18H23NO.C6H8O7/c1-15-9-7-8-12-17(15)18(20-14-13-19(2)3)16-10-5-4-6-11-16;7-3(8)1-6(13,5(11)12)2-4(9)10/h4-12,18H,13-14H2,1-3H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)
SureChEMBL ID
SCHEMBL119470
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
MMMNTDFSPSQXJP-UHFFFAOYSA-N
DSSTox substance ID
DTXSID8044678
1 reference
matched by identifier from
InChIKey
InChIKey
MMMNTDFSPSQXJP-UHFFFAOYSA-N
UNII
X0A40N8I4S
1 reference
matched by identifier from
InChIKey
InChIKey
MMMNTDFSPSQXJP-UHFFFAOYSA-N
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