KEGG   COMPOUND: C08309
Entry
C08309                      Compound                               
Name
N,N-Dimethyl-5-methoxytryptamine;
O-Methylbufotenine;
Methoxybufotenin;
5-Methoxy-N,N-dimethyltryptamine;
3-[2-(N,N-Dimethylamino)ethyl]-5-methoxy-indole
Formula
C13H18N2O
Exact mass
218.1419
Mol weight
218.2948
Structure
Brite
Phytochemical compounds [BR:br08003]
 Alkaloids
  Alkaloids derived from tryptophan and anthranilic acid
   Indole alkaloids
    C08309  N,N-Dimethyl-5-methoxytryptamine
Other DBs
CAS: 1019-45-0
PubChem: 10507
ChEBI: 2086
KNApSAcK: C00001420
NIKKAJI: J21.248B
KCF data

ATOM        16
            1   C8y C    29.7559  -15.3350
            2   C8y C    29.7618  -13.9337
            3   C8y C    31.0814  -15.7729
            4   C8x C    28.5472  -16.0357
            5   N4x N    31.0988  -13.5132
            6   C8x C    28.5472  -13.2272
            7   C8x C    31.9104  -14.6460
            8   C1b C    31.7761  -16.9816
            9   C8y C    27.3268  -15.3350
            10  C8x C    27.3268  -13.9337
            11  C1b C    31.0814  -18.1962
            12  O2a O    26.1183  -16.0357
            13  N1c N    31.7821  -19.4106
            14  C1a C    24.9037  -15.3467
            15  C1a C    31.0871  -20.6251
            16  C1a C    32.7747  -20.3975
BOND        17
            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     3   8 1
            8     4   9 2
            9     6  10 2
            10    8  11 1
            11    9  12 1
            12   11  13 1
            13   12  14 1
            14   13  15 1
            15   13  16 1
            16    5   7 1
            17    9  10 1

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