KEGG   COMPOUND: C06872Help
Entry
C06872                      Compound                               

Name
Carboprost
Formula
C21H36O5
Exact mass
368.2563
Mol weight
368.5075
Structure
Mol fileKCF fileDB search
Remark
Same as: D02343
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 G GENITO URINARY SYSTEM AND SEX HORMONES
  G02 OTHER GYNECOLOGICALS
   G02A UTEROTONICS
    G02AD Prostaglandins
     G02AD04 Carboprost
      D02343  Carboprost (USAN/INN)
USP drug classification [BR:br08302]
 Hormonal Agents, Stimulant/Replacement/Modifying (Prostaglandins)
  Carboprost
   D02343  Carboprost (USAN/INN)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Prostaglandin
    PTGFR
     D02343  Carboprost (USAN/INN)
BRITE hierarchy
Other DBs
CAS: 35700-23-3
PubChem: 9089
ChEBI: 3403
ChEMBL: CHEMBL1237122
NIKKAJI: J17.442D
LinkDB All DBs
KCF data Show

ATOM        26
            1   C1b C    28.2575  -13.9650
            2   C1b C    29.4497  -14.6534
            3   C1b C    30.6420  -13.9650
            4   C6a C    31.8343  -14.6534
            5   O6a O    33.0266  -13.9650
            6   C1y C    23.2596  -16.4431
            7   C1y C    23.2596  -15.0664
            8   C1y C    21.9517  -14.6534
            9   C1x C    21.1258  -15.7548
            10  C1y C    21.9517  -16.8562
            11  O1a O    21.5309  -13.3426
            12  O1a O    21.5309  -18.1671
            13  C1b C    24.4519  -13.9650
            14  C2b C    25.5755  -14.6534
            15  C2b C    27.1587  -14.6534
            16  O6a O    31.8343  -16.0298
            17  C2b C    24.4519  -17.6134
            18  C2b C    25.6443  -16.9250
            19  C1d C    26.8365  -17.6134
            20  C1b C    28.0288  -16.9250
            21  C1b C    29.2212  -17.6134
            22  C1b C    30.4134  -16.9250
            23  C1b C    31.6057  -17.6134
            24  O1a O    27.8101  -18.5868
            25  C1a C    32.7854  -16.9322
            26  C1a C    25.8472  -18.6027
BOND        26
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     6   7 1
            6     7   8 1
            7     8   9 1
            8     9  10 1
            9     6  10 1
            10    8  11 1 #Down
            11   10  12 1 #Down
            12    7  13 1 #Down
            13   13  14 1
            14   14  15 2
            15    1  15 1
            16    4  16 2
            17    6  17 1 #Up
            18   17  18 2
            19   18  19 1
            20   19  20 1
            21   20  21 1
            22   21  22 1
            23   22  23 1
            24   19  24 1 #Down
            25   23  25 1
            26   19  26 1 #Up

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