KEGG   COMPOUND: C13634
Entry
C13634                      Compound                               
Name
2,3-Bis(4-hydroxyphenyl)-1,2-propanediol
Formula
C15H16O4
Exact mass
260.1049
Mol weight
260.28
Structure
Reaction
R06888 R06889
Pathway
map00363  Bisphenol degradation
map01120  Microbial metabolism in diverse environments
Enzyme
1.13.-.-        1.14.-.-
Other DBs
CAS: 139755-03-6
PubChem: 586250
NIKKAJI: J1.321.974E
LinkDB
KCF data

ATOM        19
            1   C1b C    28.2351  -16.5968
            2   C8x C    24.5893  -17.2732
            3   C8y C    24.5812  -18.6738
            4   C8x C    25.7941  -19.3847
            5   C8x C    27.0078  -18.6877
            6   C8y C    27.0159  -17.2871
            7   C8x C    25.8101  -16.5833
            8   O1a O    23.3635  -19.3715
            9   C1d C    29.4378  -17.3009
            10  C8y C    30.6560  -16.6115
            11  C8x C    31.8586  -17.3182
            12  C8x C    33.0767  -16.6286
            13  C8y C    33.0852  -15.2280
            14  C8x C    31.8755  -14.5168
            15  C8x C    30.6573  -15.2133
            16  O1a O    34.3033  -14.5313
            17  O1a O    28.3624  -18.2037
            18  C1b C    30.6437  -18.0006
            19  O1a O    30.6366  -19.4014
BOND        20
            1     3   4 1
            2     9  10 1
            3     4   5 2
            4     5   6 1
            5     6   7 2
            6     7   2 1
            7     6   1 1
            8    10  11 2
            9    11  12 1
            10   12  13 2
            11   13  14 1
            12   14  15 2
            13   15  10 1
            14   13  16 1
            15    3   8 1
            16    9  17 1
            17    2   3 2
            18    9  18 1
            19    1   9 1
            20   18  19 1

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