KEGG   COMPOUND: C05300Help
Entry
C05300                      Compound                               

Name
16alpha-Hydroxyestrone
Formula
C18H22O3
Exact mass
286.1569
Mol weight
286.3655
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Steroid hormone biosynthesis
Metabolic pathways
Enzyme
1.1.1.62        1.14.13.-       1.14.14.1
Brite
Compounds with biological roles [BR:br08001]
 Hormones and transmitters
  Steroid hormones
   Estrogens
    C05300  16alpha-Hydroxyestrone
Lipids [BR:br08002]
 ST  Sterol Lipids
  ST02 Steroids
   ST0201 C18 steroids (estrogens) and derivatives
    C05300  16alpha-Hydroxyestrone
BRITE hierarchy
Other DBs
CAS: 
566-76-7
PubChem: 
ChEBI: 
LIPIDMAPS: 
PDB-CCD: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        21
            1   C8x C    14.5392  -17.1880
            2   C8y C    14.5392  -18.5515
            3   C8x C    15.7200  -19.2333
            4   C8y C    16.9010  -18.5515
            5   C8y C    16.9010  -17.1880
            6   C8x C    15.7200  -16.5062
            7   C1x C    18.0818  -19.2333
            8   C1x C    19.2627  -18.5515
            9   C1y C    19.2627  -17.1880
            10  C1y C    18.0818  -16.5062
            11  C1y C    20.4436  -16.5062
            12  C1z C    20.4436  -15.1426
            13  C1x C    19.2627  -14.4608
            14  C1x C    18.0818  -15.1426
            15  C1x C    22.8053  -16.5062
            16  C1y C    22.8053  -15.1426
            17  C5x C    21.6245  -14.4608
            18  C1a C    20.4436  -13.7791
            19  O5x O    21.6245  -13.0973
            20  O1a O    13.3583  -19.2333
            21  O1a O    23.9737  -14.4680
BOND        24
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            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   12  18 1 #Up
            22   17  19 2
            23    2  20 1
            24   16  21 1 #Down

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