KEGG   COMPOUND: C06538Help
Entry
C06538                      Compound                               

Name
Harmine
Formula
C13H12N2O
Exact mass
212.095
Mol weight
212.2472
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map01063  Biosynthesis of alkaloids derived from shikimate pathway
Enzyme
1.3.-.-
Brite
Phytochemical compounds [BR:br08003]
 Alkaloids
  Alkaloids derived from tryptophan and anthranilic acid
   Indole alkaloids
    C06538  Harmine
BRITE hierarchy
Other DBs
CAS: 442-51-3
PubChem: 8768
ChEBI: 28121
ChEMBL: CHEMBL269538
KNApSAcK: C00001737
PDB-CCD: HRM[PDBj]
3DMET: B02061
NIKKAJI: J11.378F
LinkDB All DBs
KCF data Show

ATOM        16
            1   C8y C    27.1822  -16.3787
            2   C8y C    25.8573  -15.9508
            3   C8y C    28.0146  -15.2531
            4   C8x C    27.7449  -17.6627
            5   C8y C    25.8630  -14.5495
            6   C8x C    24.6554  -16.6543
            7   N4x N    27.1939  -14.1274
            8   C8y C    29.4041  -15.4113
            9   C8x C    29.1343  -17.8150
            10  C8x C    24.6554  -13.8460
            11  C8x C    23.4359  -15.9508
            12  N5x N    29.9669  -16.6894
            13  C1a C    30.2365  -14.2799
            14  C8y C    23.4359  -14.5495
            15  O2a O    22.2223  -13.8460
            16  C1a C    21.0030  -14.5495
BOND        18
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 1
            5     2   6 2
            6     3   7 1
            7     3   8 1
            8     4   9 2
            9     5  10 2
            10    6  11 1
            11    8  12 2
            12    8  13 1
            13   10  14 1
            14   14  15 1
            15   15  16 1
            16    5   7 1
            17    9  12 1
            18   11  14 2

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