KEGG   COMPOUND: C01618
Entry
C01618                      Compound                               

Name
Testolate
Formula
C19H28O4
Exact mass
320.1988
Mol weight
320.4232
Structure
Reaction
Enzyme
Other DBs
PubChem: 4770
ChEBI: 17525
LIPIDMAPS: LMST02020081
NIKKAJI: J2.733.872K
KCF data

ATOM        23
            1   C1y C    24.4710  -17.8986
            2   C1z C    23.2444  -18.6053
            3   C1y C    25.6741  -18.6053
            4   C1x C    24.4710  -16.4969
            5   C2y C    23.2444  -20.0244
            6   C1x C    22.0297  -17.8986
            7   C1a C    23.2444  -17.2854
            8   C1y C    26.8831  -17.9219
            9   C1x C    25.6741  -20.0244
            10  C1x C    25.6741  -15.8311
            11  C1x C    24.4710  -20.7253
            12  C2x C    22.0297  -20.7253
            13  C1x C    20.8207  -18.6053
            14  C1z C    26.8831  -16.5494
            15  C1b C    28.0980  -18.6286
            16  C5x C    20.8207  -20.0244
            17  O1a O    28.0863  -15.8486
            18  C1a C    26.8831  -15.1069
            19  O5x O    19.6294  -20.7312
            20  C1b C    28.0942  -20.0121
            21  C6a C    29.3010  -20.7036
            22  O6a O    29.3010  -22.0940
            23  O6a O    30.5100  -20.0031
BOND        25
            1     2   5 1
            2     2   6 1
            3     2   7 1 #Up
            4     3   8 1
            5     3   9 1
            6     4  10 1
            7     5  11 1
            8     5  12 2
            9     6  13 1
            10    8  14 1
            11    8  15 1
            12   12  16 1
            13   14  17 1
            14   14  18 1 #Up
            15   16  19 2
            16    9  11 1
            17   10  14 1
            18   13  16 1
            19   15  20 1
            20    1   2 1
            21   20  21 1
            22    1   3 1
            23   21  22 2
            24    1   4 1
            25   21  23 1

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