KEGG   DRUG: Copper undecylenate
Entry
D08894                      Drug                                   
Name
Copper undecylenate (USAN)
Formula
(C11H19O2)2. Cu
Exact mass
429.2066
Mol weight
430.08
Structure
Simcomp
Remark
ATC code: D01AE04
Chemical structure group: DG00373
Efficacy
Antifungal
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 D DERMATOLOGICALS
  D01 ANTIFUNGALS FOR DERMATOLOGICAL USE
   D01A ANTIFUNGALS FOR TOPICAL USE
    D01AE Other antifungals for topical use
     D01AE04 Undecylenic acid
      D08894  Copper undecylenate (USAN)
Other DBs
CAS: 35322-29-3
PubChem: 96025577
LigandBox: D08894
NIKKAJI: J260.585F
LinkDB
KCF data

ATOM        27
            1   O6a O    18.3624  -15.2600 #-
            2   C6a C    19.5749  -15.9600
            3   C1b C    20.7873  -15.2600
            4   C1b C    21.9997  -15.9600
            5   C1b C    23.2122  -15.2600
            6   C1b C    24.4246  -15.9600
            7   C1b C    25.6370  -15.2600
            8   C1b C    26.8495  -15.9600
            9   C1b C    28.0619  -15.2600
            10  C1b C    29.2744  -15.9600
            11  C2b C    30.4868  -15.2600
            12  C2a C    31.6992  -15.9600
            13  O6a O    19.5749  -17.3598
            14  Z   Cu   37.2400  -16.9400 #2+
            15  O6a O    18.3624  -15.2600 #-
            16  C6a C    19.5749  -15.9600
            17  C1b C    20.7873  -15.2600
            18  C1b C    21.9997  -15.9600
            19  C1b C    23.2122  -15.2600
            20  C1b C    24.4246  -15.9600
            21  C1b C    25.6370  -15.2600
            22  C1b C    26.8495  -15.9600
            23  C1b C    28.0619  -15.2600
            24  C1b C    29.2744  -15.9600
            25  C2b C    30.4868  -15.2600
            26  C2a C    31.6992  -15.9600
            27  O6a O    19.5749  -17.3598
BOND        24
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     6   7 1
            7     7   8 1
            8     8   9 1
            9     9  10 1
            10   10  11 1
            11   11  12 2
            12    2  13 2
            13   15  16 1
            14   16  17 1
            15   17  18 1
            16   18  19 1
            17   19  20 1
            18   20  21 1
            19   21  22 1
            20   22  23 1
            21   23  24 1
            22   24  25 1
            23   25  26 2
            24   16  27 2
BRACKET     1    16.4500  -18.4100   16.4500  -13.6500
            1    33.6700  -13.6500   33.6700  -18.4100
            1  2
 ORIGINAL  1    1   2   3   4   5   6   7   8   9  10  11  12  13
 REPEAT    1   15  16  17  18  19  20  21  22  23  24  25  26  27

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