KEGG   COMPOUND: C17491
Entry
C17491                      Compound                               
Name
13-Hydroxygermacrone
Formula
C15H22O2
Exact mass
234.1620
Mol weight
234.33
Structure
Other DBs
PubChem: 96023837
ChEBI: 81129
KNApSAcK: C00011729
NIKKAJI: J1.008.218H
LinkDB
KCF data

ATOM        17
            1   C1x C    28.8400  -22.6800
            2   C1x C    28.8400  -24.0800
            3   C2y C    30.0524  -24.7800
            4   C2x C    31.2649  -24.0800
            5   C2y C    31.2649  -22.6800
            6   C2x C    30.0524  -21.9800
            7   C1x C    32.4773  -24.7800
            8   C2y C    33.6897  -24.0800
            9   C5x C    33.6897  -22.6800
            10  C1x C    32.4773  -21.9800
            11  C2c C    34.8873  -24.7715
            12  C1b C    36.0756  -24.0855
            13  O1a O    37.2664  -24.7731
            14  C1a C    34.8874  -26.1797
            15  O5x O    34.8873  -21.9885
            16  C1a C    31.2649  -21.2800
            17  C1a C    30.0524  -26.1800
BOND        17
            1     1   2 1
            2     2   3 1
            3     3   4 2
            4     5   6 2
            5     1   6 1
            6     4   7 1
            7     7   8 1
            8     8   9 1
            9     9  10 1
            10    5  10 1
            11    8  11 2
            12   11  12 1
            13   12  13 1
            14   11  14 1
            15    9  15 2
            16    5  16 1
            17    3  17 1

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