KEGG   COMPOUND: C13699
Entry
C13699                      Compound                               
Name
9-Anthroic acid;
Anthracene-9-carboxylic acid;
A9C
Formula
C15H10O2
Exact mass
222.0681
Mol weight
222.2387
Structure
Other DBs
CAS: 723-62-6
PubChem: 586288
ChEBI: 34507
NIKKAJI: J79.927K
LinkDB
KCF data

ATOM        17
            1   C8x C    25.2173  -17.2837
            2   C8x C    25.2173  -18.6854
            3   C8x C    26.4342  -19.3862
            4   C8x C    26.4342  -16.5828
            5   C8y C    27.6438  -17.2837
            6   C8y C    27.6379  -18.6854
            7   C8x C    28.8488  -19.3914
            8   C8y C    28.8609  -16.5881
            9   C8y C    30.0718  -17.2940
            10  C8y C    30.1290  -18.6922
            11  C8x C    31.2635  -19.4020
            12  C8x C    32.4805  -18.7141
            13  C8x C    32.4932  -17.3159
            14  C8x C    31.2888  -16.6061
            15  C6a C    28.8201  -15.1863
            16  O6a O    30.0370  -14.4907
            17  O6a O    27.6092  -14.4804
BOND        19
            1     9   8 2
            2     8   5 1
            3     5   4 2
            4     4   1 1
            5     1   2 2
            6     2   3 1
            7     3   6 2
            8     9  10 1
            9    10  11 1
            10   11  12 2
            11   12  13 1
            12   13  14 2
            13   14   9 1
            14    5   6 1
            15    8  15 1
            16    6   7 1
            17   15  16 1
            18    7  10 2
            19   15  17 2

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