KEGG   DRUG: AnthralinHelp
Entry
D00233                      Drug                                   

Name
Anthralin (USP);
Dithranol (INN);
Anthraderm (TN)
Formula
C14H10O3
Exact mass
226.063
Mol weight
226.2274
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Remark
Same as: C06831
ATC code: D05AC01
Efficacy
Antipsoriatic
  Disease
Plaque psoriasis [DS:H01656]
Comment
See C06831 (tautomer)
Antracen derivative
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 D DERMATOLOGICALS
  D05 ANTIPSORIATICS
   D05A ANTIPSORIATICS FOR TOPICAL USE
    D05AC Antracen derivatives
     D05AC01 Dithranol
      D00233  Anthralin (USP)
BRITE hierarchy
Other DBs
CAS: 1143-38-0 480-22-8
PubChem: 7847300
ChEBI: 37510
ChEMBL: CHEMBL46469
LigandBox: D00233
NIKKAJI: J5.223J J5.224H
LinkDB All DBs
KCF data Show

ATOM        17
            1   C8y C    26.1340  -18.2111
            2   C8y C    26.1397  -16.8124
            3   C5x C    27.3405  -18.9165
            4   C8y C    24.9275  -18.9106
            5   C1x C    27.3520  -16.1131
            6   C8x C    24.9275  -16.1071
            7   C8y C    28.5528  -18.2171
            8   O5x O    27.3405  -20.3154
            9   C8x C    23.7093  -18.2111
            10  O1a O    24.9275  -20.3095
            11  C8y C    28.5645  -16.8241
            12  C8x C    23.7093  -16.8124
            13  C8y C    29.7593  -18.9282
            14  C8x C    29.7827  -16.1305
            15  C8x C    30.9776  -18.2404
            16  O1a O    29.7244  -20.3271
            17  C8x C    30.9892  -16.8415
BOND        19
            1     1   2 2
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 1
            7     3   8 2
            8     4   9 2
            9     4  10 1
            10    5  11 1
            11    6  12 2
            12    7  13 2
            13   11  14 2
            14   13  15 1
            15   13  16 1
            16   14  17 1
            17    7  11 1
            18    9  12 1
            19   15  17 2

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