KEGG   COMPOUND: C22050
Entry
C22050                      Compound                               

Name
6alpha,8beta-Dihydroxygermacra-1(10),4,11(13)-trien-12-oate
Formula
C15H22O4
Exact mass
266.1518
Mol weight
266.3328
Structure
Reaction
Enzyme
Other DBs
PubChem: 384585110
ChEBI: 182520
KCF data

ATOM        19
            1   C2x C    17.3808  -14.7176
            2   C2y C    18.4320  -13.8065
            3   C1x C    19.7636  -14.1569
            4   C1y C    20.3944  -15.4184
            5   C2x C    17.3808  -16.1193
            6   C1y C    19.7636  -16.6799
            7   C1y C    18.4320  -16.9603
            8   C1x C    16.0492  -14.2270
            9   C1x C    15.2082  -15.4184
            10  C2y C    16.0492  -16.5398
            11  C1a C    15.6287  -17.8714
            12  C1a C    18.2218  -12.4048
            13  C2c C    20.6747  -17.7312
            14  C6a C    20.1140  -18.9927
            15  C2a C    22.0764  -17.5209
            16  O6a O    21.0251  -20.0440
            17  O1a O    21.7960  -15.2082
            18  O1a O    18.0697  -18.3126
            19  O6a O    18.7328  -19.1978
BOND        19
            1     3   4 1
            2     4   6 1
            3     2   3 1
            4     5   7 1
            5     1   2 2
            6     6   7 1
            7     1   8 1
            8     8   9 1
            9     9  10 1
            10    5  10 2
            11   10  11 1
            12    2  12 1
            13    6  13 1 #Up
            14   13  14 1
            15   13  15 2
            16   14  16 1
            17    4  17 1 #Up
            18    7  18 1 #Down
            19   14  19 2

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