KEGG   COMPOUND: C06546Help
Entry
C06546                      Compound                               

Name
Mescaline
Formula
C11H17NO3
Exact mass
211.1208
Mol weight
211.2576
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Biosynthesis of alkaloids derived from shikimate pathway
Brite
Phytochemical compounds [BR:br08003]
 Alkaloids
  Alkaloids derived from tyrosine
   Tyramine derivatives
    C06546  Mescaline
BRITE hierarchy
Other DBs
CAS: 
54-04-6
PubChem: 
ChEBI: 
KNApSAcK: 
3DMET: 
NIKKAJI: 
LinkDB All DBs
KCF data Show

ATOM        15
            1   C8y C    24.2200  -18.9000
            2   C8y C    25.4100  -19.6000
            3   C8y C    24.2200  -17.5000
            4   O2a O    22.9600  -19.6000
            5   C8x C    26.6000  -18.9000
            6   O2a O    25.4100  -21.0000
            7   C8x C    25.4100  -16.8000
            8   O2a O    22.9600  -16.8000
            9   C1a C    22.9600  -21.0000
            10  C8y C    26.6000  -17.5000
            11  C1a C    26.6000  -21.7000
            12  C1a C    21.7700  -17.5000
            13  C1b C    27.8600  -16.8000
            14  C1b C    29.0500  -17.5000
            15  N1a N    30.2400  -16.8000
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     3   8 1
            8     4   9 1
            9     5  10 2
            10    6  11 1
            11    8  12 1
            12   10  13 1
            13   13  14 1
            14   14  15 1
            15    7  10 1

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