KEGG   COMPOUND: C07577
Entry
C07577                      Compound                               
Name
3,4-Methylenedioxymethamphetamine;
N-Methyl-3,4-methylenedioxyamphetamine;
MDMA
Formula
C11H15NO2
Exact mass
193.1103
Mol weight
193.24
Structure
Remark
Same as: D11172
Brite
Target-based classification of drugs [BR:br08310]
 Transporters
  Solute carrier family
   SLC6
    SLC6A2 (NAT1)
     D11172  Midomafetamine (USAN/INN)
    SLC6A3 (DAT1)
     D11172  Midomafetamine (USAN/INN)
    SLC6A4 (HTT)
     D11172  Midomafetamine (USAN/INN)
   SLC18
    SLC18A2 (VMAT2)
     D11172  Midomafetamine (USAN/INN)
Narcotics and psychotropics in Japan [br08308.html]
 Narcotics by Cabinet Order Article 1 (157 substances)
  C07577
Other DBs
CAS: 42542-10-9
PubChem: 9780
ChEBI: 1391 166520
NIKKAJI: J276.360E
KCF data

ATOM        14
            1   C8y C    23.3802  -20.3477
            2   C8y C    23.3511  -21.7501
            3   C8x C    24.5854  -19.6097
            4   O2x O    22.0234  -19.9459
            5   C8x C    24.6667  -22.4356
            6   O2x O    22.0919  -22.2142
            7   C8y C    25.8106  -20.2738
            8   C1x C    21.2311  -21.1206
            9   C8x C    25.8578  -21.6859
            10  C1b C    27.0424  -19.6000
            11  C1c C    28.2549  -20.3000
            12  N1b N    29.4673  -19.6000
            13  C1a C    30.6797  -20.3000
            14  C1a C    28.2549  -21.6998
BOND        15
            1     1   2 2
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 2
            7     4   8 1
            8     5   9 2
            9     6   8 1
            10    7   9 1
            11    7  10 1
            12   10  11 1
            13   11  12 1
            14   12  13 1
            15   11  14 1

» Japanese version

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Ontology (1)   
   KEGG BRITE (1)   
Drug (1)   
   KEGG DRUG (1)   
Chemical substance (10)   
   PubChem (1)   
   ChEBI (2)   
   HSDB (1)   
   MASSBANK (5)   
   NIKKAJI (1)   
All databases (12)   

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