KEGG   DRUG: Lynestrenol
Entry
D01580                      Drug                                   
Name
Lynestrenol (JAN/USAN)
Formula
C20H28O
Exact mass
284.2140
Mol weight
284.43
Structure
Simcomp
Class
Hormonal agent
 DG02004  Progesterone
 DG01666  Progesterone receptor agonist
Remark
Same as: C13037
ATC code: G03AC02 G03DC03
Efficacy
Contraceptive, Progesterone receptor agonist
Comment
Progestin
Target
NR3C3 (PGR) [HSA:5241] [KO:K08556]
  Pathway
hsa04114  Oocyte meiosis
hsa04914  Progesterone-mediated oocyte maturation
hsa04915  Estrogen signaling pathway
Interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 G GENITO URINARY SYSTEM AND SEX HORMONES
  G03 SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
   G03A HORMONAL CONTRACEPTIVES FOR SYSTEMIC USE
    G03AC Progestogens
     G03AC02 Lynestrenol
      D01580  Lynestrenol (JAN/USAN)
   G03D PROGESTOGENS
    G03DC Estren derivatives
     G03DC03 Lynestrenol
      D01580  Lynestrenol (JAN/USAN)
Drug groups [BR:br08330]
 Hormonal agent
  DG02004  Progesterone
   D01580  Lynestrenol
  DG01666  Progesterone receptor agonist
   D01580  Lynestrenol
Target-based classification of drugs [BR:br08310]
 Nuclear receptors
  Estrogen like receptors
   3-Ketosteroid receptor
    NR3C3 (PGR)
     D01580  Lynestrenol (JAN/USAN)
Other DBs
CAS: 52-76-6
PubChem: 7848643
ChEBI: 31790
LigandBox: D01580
NIKKAJI: J4.134C
LinkDB
KCF data

ATOM        21
            1   C1x C    20.9556  -20.0583
            2   C1x C    20.9556  -21.4251
            3   C2x C    22.1422  -22.1085
            4   C1x C    22.1422  -19.3749
            5   C1y C    23.3217  -20.0583
            6   C2y C    23.3159  -21.4251
            7   C1x C    24.4967  -22.1136
            8   C1x C    25.6832  -21.4352
            9   C1y C    24.5083  -19.3801
            10  C1y C    25.6832  -20.0714
            11  C1x C    25.7056  -17.3450
            12  C1x C    24.5195  -18.0169
            13  C1z C    26.8807  -18.0361
            14  C1y C    26.8641  -19.3953
            15  C1x C    29.2881  -19.4238
            16  C1x C    29.2345  -18.0648
            17  C1z C    28.0659  -17.3710
            18  C3b C    29.2461  -16.6760
            19  O1a O    28.0588  -15.7194
            20  C3a C    30.4266  -15.9856
            21  C1a C    26.8714  -16.6690
BOND        24
            1    13  11 1
            2    11  12 1
            3    12   9 1
            4     2   3 1
            5     3   6 2
            6     5   6 1
            7     6   7 1
            8     7   8 1
            9    13  14 1
            10   15  16 1
            11   16  17 1
            12   17  13 1
            13   14  15 1
            14    8  10 1
            15   17  18 1 #Down
            16    9   5 1
            17   17  19 1 #Up
            18    5   4 1
            19   18  20 3
            20    4   1 1
            21   13  21 1 #Up
            22    1   2 1
            23    9  10 1
            24   10  14 1

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