KEGG   COMPOUND: C18040Help
Entry
C18040                      Compound                               

Name
5alpha-Dihydrodeoxycorticosterone;
5alpha-Pregnan-21-ol-3,20-dione;
Allopregnane-21-ol-3,20-dione
Formula
C21H32O3
Exact mass
332.2351
Mol weight
332.477
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00140  Steroid hormone biosynthesis
Enzyme
1.1.1.213       1.3.1.22
Other DBs
CAS: 298-36-2
PubChem: 96024260
ChEBI: 81468
ChEMBL: CHEMBL3137790
NIKKAJI: J322.211J
KCF data Show

ATOM        24
            1   C1x C    17.5000  -20.5800
            2   C5x C    17.5000  -21.9100
            3   C1x C    18.6900  -22.6100
            4   C1y C    19.8800  -21.9100
            5   C1z C    19.8800  -20.5800
            6   C1x C    18.6900  -19.8800
            7   C1x C    21.0700  -22.6100
            8   C1x C    22.2600  -21.9100
            9   C1y C    22.2600  -20.5800
            10  C1y C    21.0700  -19.8800
            11  C1y C    23.4500  -19.8800
            12  C1z C    23.4500  -18.5500
            13  C1x C    22.2600  -17.8500
            14  C1x C    21.0700  -18.5500
            15  C1x C    25.8300  -19.8800
            16  C1x C    25.8300  -18.5500
            17  C1y C    24.6400  -17.8500
            18  O5x O    16.3100  -22.6100
            19  C1a C    19.8800  -19.1800
            20  C1a C    23.4500  -17.1500
            21  C5a C    24.6400  -16.4500
            22  O5a O    23.4276  -15.7500
            23  C1b C    25.8524  -15.7500
            24  O1a O    27.0649  -16.4500
BOND        27
            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 2
            22    5  19 1 #Up
            23   12  20 1 #Up
            24   17  21 1 #Up
            25   21  22 2
            26   21  23 1
            27   23  24 1

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