KEGG   DRUG: Sapropterin
Entry
D08505                      Drug                                   
Name
Sapropterin (INN)
Formula
C9H15N5O3
Exact mass
241.1175
Mol weight
241.2471
Structure
Simcomp
Remark
ATC code: A16AX07
Chemical structure group: DG00147
Product (DG00147): D01798<JP/US>
Efficacy
Antihyperphenylalaninemia
Comment
synthetic 6R-isomer of Tetrahydrobiopterin [CPD:C00272]
Drug for metabolic disease treatment
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 A ALIMENTARY TRACT AND METABOLISM
  A16 OTHER ALIMENTARY TRACT AND METABOLISM PRODUCTS
   A16A OTHER ALIMENTARY TRACT AND METABOLISM PRODUCTS
    A16AX Various alimentary tract and metabolism products
     A16AX07 Sapropterin
      D08505  Sapropterin (INN)
Other DBs
CAS: 62989-33-7
PubChem: 96025190
ChEBI: 59560
PDB-CCD: H4B[PDBj]
LigandBox: D08505
NIKKAJI: J463.663E
LinkDB
KCF data

ATOM        17
            1   N4x N    14.9952  -16.1921
            2   C8y C    14.9952  -17.5884
            3   N5x N    16.2518  -18.2865
            4   C8y C    16.2518  -15.4940
            5   C8y C    17.4387  -16.1921
            6   C8y C    17.4387  -17.5884
            7   N1x N    18.6255  -18.2865
            8   C1x C    19.8821  -17.5884
            9   C1y C    19.8821  -16.1921
            10  N1x N    18.6255  -15.4940
            11  C1c C    21.0689  -15.4940
            12  C1c C    22.2558  -16.1921
            13  C1a C    23.5124  -15.4940
            14  O1a O    22.2558  -17.5884
            15  O1a O    21.0689  -14.0977
            16  N1a N    13.8084  -18.2865
            17  O5x O    16.2518  -14.0977
BOND        18
            1     8   9 1
            2     9  10 1
            3    10   5 1
            4     4   1 1
            5     9  11 1
            6    11  12 1
            7    12  13 1
            8     1   2 1
            9    12  14 1 #Down
            10    2   3 2
            11   11  15 1 #Up
            12    3   6 1
            13    2  16 1
            14    5   4 1
            15    4  17 2
            16    5   6 2
            17    6   7 1
            18    7   8 1

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