KEGG   COMPOUND: C05481Help
Entry
C05481                      Compound                               

Name
Cortolone
Formula
C21H34O5
Exact mass
366.2406
Mol weight
366.4917
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Steroid hormone biosynthesis
Enzyme
Other DBs
CAS: 
516-42-7
PubChem: 
ChEBI: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        26
            1   C1x C    14.4900  -25.1300
            2   C1y C    14.4900  -26.5300
            3   C1x C    15.7024  -27.2300
            4   C1y C    16.9149  -26.5300
            5   C1z C    16.9149  -25.1300
            6   C1x C    15.7024  -24.4300
            7   C1x C    18.1273  -27.2300
            8   C1x C    19.3397  -26.5300
            9   C1y C    19.3397  -25.1300
            10  C1y C    18.1273  -24.4300
            11  C1y C    20.5522  -24.4300
            12  C1z C    20.5522  -23.0300
            13  C1x C    19.3397  -22.3300
            14  C5x C    18.1273  -23.0300
            15  C1x C    22.9770  -24.4300
            16  C1x C    22.9770  -23.0300
            17  C1z C    21.7646  -22.3300
            18  O1a O    13.2776  -27.2300
            19  C1c C    21.7646  -20.9300
            20  C1b C    22.9811  -20.2277
            21  O1a O    24.1786  -20.9192
            22  O1a O    20.5562  -20.2323
            23  C1a C    20.5522  -21.6300
            24  C1a C    16.9149  -23.7300
            25  O5x O    16.9169  -22.3312
            26  O1a O    23.1169  -21.9677
BOND        29
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     1   6 1
            7     4   7 1
            8     7   8 1
            9     8   9 1
            10    9  10 1
            11    5  10 1
            12    9  11 1
            13   11  12 1
            14   12  13 1
            15   13  14 1
            16   10  14 1
            17   11  15 1
            18   15  16 1
            19   16  17 1
            20   12  17 1
            21    2  18 1 #Down
            22   17  19 1
            23   19  20 1
            24   20  21 1
            25   19  22 1 #Up
            26   12  23 1 #Up
            27    5  24 1 #Up
            28   14  25 2
            29   17  26 1 #Down

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