KEGG   COMPOUND: C07577Help
Entry
C07577                      Compound                               

Name
3,4-Methylenedioxymethamphetamine;
N-Methyl-3,4-methylenedioxyamphetamine;
MDMA
Formula
C11H15NO2
Exact mass
193.1103
Mol weight
193.2423
Structure
Mol fileKCF fileDB searchJmolKegDraw
Brite
Target-based classification of compounds [BR:br08010]
 Transporters
  Solute carrier family
   SLC6
    SLC6A4
     C07577  3,4-Methylenedioxymethamphetamine
BRITE hierarchy
Other DBs
CAS: 
42542-10-9
PubChem: 
ChEBI: 
NIKKAJI: 
KCF data Show

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

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