KEGG   COMPOUND: C08310Help
Entry
C08310                      Compound                               

Name
N-Methylmescaline
Formula
C12H19NO3
Exact mass
225.1365
Mol weight
225.2842
Structure
Mol fileKCF fileDB search
Brite
Phytochemical compounds [BR:br08003]
 Alkaloids
  Alkaloids derived from tyrosine
   Tyramine derivatives
    C08310  N-Methylmescaline
BRITE hierarchy
Other DBs
CAS: 4838-96-4
PubChem: 10508
ChEBI: 7319
ChEMBL: CHEMBL100531
KNApSAcK: C00001421
NIKKAJI: J886.522A
LinkDB All DBs
KCF data Show

ATOM        16
            1   C8y C    30.0665  -17.3053
            2   C8y C    31.2779  -16.6089
            3   C8x C    28.8492  -16.6089
            4   O2a O    30.0665  -18.7098
            5   C8y C    31.2779  -15.2103
            6   O2a O    32.4891  -17.3053
            7   C8y C    28.8492  -15.2103
            8   C1a C    28.8551  -19.4119
            9   C8x C    30.0665  -14.5081
            10  O2a O    32.4891  -14.5081
            11  C1a C    32.4891  -18.7098
            12  C1b C    27.6378  -14.5081
            13  C1a C    33.7004  -15.2103
            14  C1b C    26.4265  -15.2044
            15  N1b N    25.2151  -14.5081
            16  C1a C    23.9980  -15.1927
BOND        16
            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     5  10 1
            10    6  11 1
            11    7  12 1
            12   10  13 1
            13   12  14 1
            14   14  15 1
            15   15  16 1
            16    7   9 1

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