KEGG   COMPOUND: C06390
Entry
C06390                      Compound                               

Name
16-alpha-Hydroxypregnenolone;
16alpha-Hydroxypregnenolone
Formula
C21H32O3
Exact mass
332.2351
Mol weight
332.477
Structure
Reaction
Enzyme
Other DBs
CAS: 520-88-7
PubChem: 8626
ChEBI: 771
ChEMBL: CHEMBL1908004
LIPIDMAPS: LMST02030172
NIKKAJI: J564.832G
KCF data

ATOM        24
            1   C1y C    28.7324  -20.3528
            2   C1y C    29.8405  -19.6645
            3   C1y C    27.4958  -19.6762
            4   C1x C    28.6739  -21.7059
            5   C1z C    29.8465  -18.3171
            6   C1x C    32.2085  -19.6818
            7   C1z C    26.3409  -20.3585
            8   C1x C    27.4841  -18.3288
            9   C2x C    27.5015  -22.3709
            10  C1y C    31.0188  -17.6405
            11  C1x C    28.6565  -17.6465
            12  C1a C    29.7121  -16.6256
            13  C1y C    32.1852  -18.3230
            14  C2y C    26.3409  -21.7000
            15  C1x C    25.1802  -19.6937
            16  C1a C    26.2244  -18.6964
            17  C5a C    31.0188  -16.2757
            18  O1a O    33.3635  -17.6347
            19  C1x C    25.1802  -22.3767
            20  C1x C    24.0371  -20.3585
            21  C1a C    32.1618  -15.6108
            22  O5a O    29.8696  -15.6167
            23  C1y C    24.0371  -21.7000
            24  O1a O    22.8881  -22.3533
BOND        27
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 1
            7     3   8 1
            8     4   9 1
            9     5  10 1
            10    5  11 1
            11    5  12 1 #Up
            12    6  13 1
            13    7  14 1
            14    7  15 1
            15    7  16 1 #Up
            16   10  17 1 #Up
            17   13  18 1 #Down
            18   14  19 1
            19   15  20 1
            20   17  21 1
            21   17  22 2
            22   19  23 1
            23   23  24 1 #Up
            24    8  11 1
            25    9  14 2
            26   10  13 1
            27   20  23 1

» Japanese version

DBGET integrated database retrieval system