Marvin  03291215222D          

 13 15  0  0  0  0            999 V2000
    7.5190   -4.9962    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5190   -5.8212    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9479   -5.8212    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2334   -6.2337    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7869   -6.3006    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7869   -5.4756    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9479   -4.9962    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0725   -6.6343    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5413   -6.6343    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2334   -4.5837    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2334   -3.7587    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.7508   -6.0108    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7221   -6.0347    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 10  1  1  0  0  0  0
 10  7  1  0  0  0  0
  1  2  1  0  0  0  0
  2  4  1  0  0  0  0
  3  7  1  0  0  0  0
  9  3  1  0  0  0  0
  3  4  1  0  0  0  0
  8  5  1  0  0  0  0
  9  5  1  0  0  0  0
  8  2  1  0  0  0  0
  5  6  1  0  0  0  0
 10  6  1  0  0  0  0
 10 11  1  0  0  0  0
  3 12  1  0  0  0  0
  2 13  1  0  0  0  0
M  END
> <ID>
CHEBI:64312

> <NAME>
memantine

> <DEFINITION>
A primary aliphatic amine that is the 3,5-dimethyl derivative of 1-aminoadamantane. A low to moderate affinity uncompetitive (open-channel); NMDA receptor antagonist which binds preferentially to the NMDA receptor-operated cation channels.

> <STAR>
3

> <SECONDARY_ID>
CHEBI:34832

> <SYNONYM>
3,5-Dimethyltricyclo(3.3.1.1(3,7))decan-1-amine; 3,5-Dimethyl-1-aminoadamantane; 3,5-Dimethyl-1-adamantanamine; 1-Amino-3,5-dimethyladamantane; 1,3-Dimethyl-5-adamantanamine

> <IUPAC_NAME>
3,5-dimethyladamantan-1-amine

> <INN>
memantinum; memantine; memantina

> <FORMULA>
C12H21N

> <MASS>
179.30180

> <MONOISOTOPIC_MASS>
179.16740

> <CHARGE>
0

> <SMILES>
CC12CC3CC(C)(C1)CC(N)(C3)C2

> <INCHI>
InChI=1S/C12H21N/c1-10-3-9-4-11(2,6-10)8-12(13,5-9)7-10/h9H,3-8,13H2,1-2H3

> <INCHIKEY>
BUGYDGFZZOZRHP-UHFFFAOYSA-N

> <CAS_REGISTRY_NUMBER>
19982-08-2

> <REAXYS_REGISTRY_NUMBER>
2075983

> <CHEMIDPLUS>
19982-08-2

> <DRUGBANK_ACCESSION>
DB01043

> <KEGG_COMPOUND_ACCESSION>
C13736

> <KEGG_DRUG_ACCESSION>
D08174

> <LINCS_ACCESSION>
LSM-5154

> <NIST_CHEMISTRY_WEBBOOK>
19982-08-2

> <WIKIPEDIA_ACCESSION>
Memantine

> <PUBMED_CITATION>
20104942; 21953515; 21955815; 22030128; 22134197; 22245025; 22248638; 22290557; 22297273; 22300835; 22311362; 22327556; 22329473; 22392787; 22414570; 22425751

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