KEGG   COMPOUND: C18038
Entry
C18038                      Compound                               
Name
7alpha-Hydroxypregnenolone;
3beta,7alpha-Dihydroxy-5-pregnen-20-one
Formula
C21H32O3
Exact mass
332.2351
Mol weight
332.477
Structure
Reaction
Pathway
map00140  Steroid hormone biosynthesis
Enzyme
Other DBs
PubChem: 96024258
ChEBI: 81467
NIKKAJI: J704.244B
LinkDB
KCF data

ATOM        24
            1   C1x C     8.0500  -21.1400
            2   C1y C     8.0500  -22.5400
            3   C1x C     9.2624  -23.2400
            4   C2y C    10.4749  -22.5400
            5   C1z C    10.4749  -21.1400
            6   C1x C     9.2624  -20.4400
            7   C2x C    11.6873  -23.2400
            8   C1y C    12.8997  -22.5400
            9   C1y C    12.8997  -21.1400
            10  C1y C    11.6873  -20.4400
            11  C1y C    14.1122  -20.4400
            12  C1z C    14.1122  -19.0400
            13  C1x C    12.8997  -18.3400
            14  C1x C    11.6873  -19.0400
            15  C1x C    16.5370  -20.4400
            16  C1x C    16.5370  -19.0400
            17  C1y C    15.3246  -18.3400
            18  O1a O     6.8376  -23.2400
            19  C1a C    10.4749  -19.7402
            20  C1a C    14.1122  -17.6400
            21  C5a C    15.3246  -16.9400
            22  O1a O    14.0973  -23.2315
            23  O5a O    16.3145  -15.9501
            24  C1a C    14.3347  -15.9501
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 2
            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 #Up
            22    5  19 1 #Up
            23   12  20 1 #Up
            24   17  21 1 #Up
            25    8  22 1 #Down
            26   21  23 2
            27   21  24 1

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