KEGG   DRUG: Fosdenopterin hydrobromide
Entry
D11780                      Drug                                   

Name
Fosdenopterin hydrobromide (USAN);
Fosdenopterin hydrobromide dihydrate;
Nulibry (TN)
Formula
C10H14N5O8P. 2H2O. HBr
Exact mass
479.0053
Mol weight
480.1631
Structure
Remark
Chemical structure group: DG03102
Efficacy
Cofactor replacement
  Disease
Molybdenum cofactor deficiency type A [DS:H02311]
Comment
Cofactor replacement therapy
Treatment of molybdenum cofactor deficiency, type A
Target
MOCS1* [HSA_VAR:4337v1] [HSA:4337] [KO:K20967]
  Pathway
hsa00790  Folate biosynthesis
Brite
Target-based classification of drugs [BR:br08310]
 Enzymes
  Lyases (EC4)
   Moco biosynthesis enzyme
    MOCS1* [HSA_VAR:4337v1]
     D11780  Fosdenopterin hydrobromide (USAN)
New drug approvals in the USA [br08319.html]
 New molecular entities and new therapeutic biological products
  D11780
New drug approvals in the USA, Europe and Japan [br08328.html]
 Approval dates by FDA, EMA and PMDA
  D11780
Other DBs
CAS: 2301083-34-9
PubChem: 405226646
ChEMBL: CHEMBL4594300
LinkDB
KCF data

ATOM        27
            1   C8y C    16.2404  -17.2204
            2   C8y C    16.2404  -15.8204
            3   C8y C    15.0504  -15.1204
            4   N5x N    13.7903  -15.8204
            5   C8y C    13.7903  -17.2204
            6   N4x N    15.0504  -17.9204
            7   N1x N    17.4304  -17.9204
            8   C1y C    18.6905  -17.2204
            9   C1y C    18.6905  -15.8204
            10  N1x N    17.4304  -15.1204
            11  O2x O    19.8805  -17.9204
            12  C1y C    21.0705  -17.2204
            13  C1y C    21.0705  -15.8204
            14  C1z C    19.8805  -15.1204
            15  C1x C    22.3305  -17.9204
            16  O2x O    23.5206  -17.2204
            17  P1b P    23.5206  -15.8204
            18  O2x O    22.3305  -15.1204
            19  O5x O    15.0504  -13.7203
            20  O1a O    20.5805  -13.9303
            21  O1a O    19.1805  -13.9303
            22  O1c O    24.7106  -16.5204
            23  O1c O    23.5206  -14.4203
            24  N1a N    12.6003  -17.9204
            25  X   Br   27.5100  -15.0500
            26  O0  O    28.1400  -18.6200
            27  O0  O    28.1400  -18.6200
BOND        27
            1     1   2 2
            2     2   3 1
            3     3   4 1
            4     4   5 2
            5     5   6 1
            6     1   6 1
            7     1   7 1
            8     7   8 1
            9     8   9 1
            10    9  10 1
            11    2  10 1
            12    8  11 1
            13   11  12 1
            14   12  13 1
            15   13  14 1
            16    9  14 1
            17   12  15 1
            18   15  16 1
            19   16  17 1
            20   17  18 1
            21   13  18 1
            22    3  19 2
            23   14  20 1
            24   14  21 1
            25   17  22 1
            26   17  23 2
            27    5  24 1
BRACKET     1    26.0400  -19.3200   26.0400  -17.6400
            1    28.9800  -17.6400   28.9800  -19.3200
            1  2
 ORIGINAL  1   30
 REPEAT    1   31

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