KEGG   COMPOUND: C19561
Entry
C19561                      Compound                               
Name
7-Hydroxymethyl-12-methylbenz[a]anthracene;
12-Methylbenz[a]anthracene-7-methanol
Formula
C20H16O
Exact mass
272.1201
Mol weight
272.3404
Structure
Reaction
R09441 R09444
Pathway
map00980  Metabolism of xenobiotics by cytochrome P450
map05204  Chemical carcinogenesis - DNA adducts
Enzyme
1.14.14.-       2.8.2.14
Other DBs
CAS: 568-75-2
PubChem: 124490233
ChEBI: 82559
KCF data

ATOM        21
            1   C8x C    18.6900  -19.0401
            2   C8x C    18.6900  -20.4401
            3   C8x C    19.9024  -21.1401
            4   C8y C    21.1149  -20.4401
            5   C8y C    21.1149  -19.0401
            6   C8x C    19.9024  -18.3401
            7   C8y C    22.3273  -21.1401
            8   C8y C    23.5397  -20.4401
            9   C8y C    23.5397  -19.0401
            10  C8y C    22.3273  -18.3401
            11  C8x C    24.7523  -21.1401
            12  C8x C    25.9647  -20.4401
            13  C8y C    25.9647  -19.0401
            14  C8y C    24.7523  -18.3401
            15  C8x C    27.1771  -18.3401
            16  C8x C    27.1771  -16.9401
            17  C8x C    25.9647  -16.2401
            18  C8x C    24.7523  -16.9401
            19  C1a C    22.3273  -16.9401
            20  C1b C    22.3273  -22.5401
            21  O1a O    23.5417  -23.2412
BOND        24
            1     1   2 1
            2     2   3 2
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     1   6 2
            7     4   7 2
            8     7   8 1
            9     8   9 1
            10    9  10 1
            11    5  10 2
            12    8  11 2
            13   11  12 1
            14   12  13 2
            15   13  14 1
            16    9  14 2
            17   13  15 1
            18   15  16 2
            19   16  17 1
            20   17  18 2
            21   14  18 1
            22   10  19 1
            23    7  20 1
            24   20  21 1

» Japanese version

  All links  
Pathway (2)   
   KEGG PATHWAY (2)   
Chemical substance (2)   
   PubChem (1)   
   ChEBI (1)   
Chemical reaction (3)   
   KEGG ENZYME (1)   
   KEGG REACTION (2)   
Gene (380)   
   KEGG GENES (380)   
All databases (387)   

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