KEGG   COMPOUND: C08261Help
Entry
C08261                      Compound                               

Name
Azelaic acid;
Nonanedioic acid;
1,7-Heptanedicarboxylic acid
Formula
C9H16O4
Exact mass
188.1049
Mol weight
188.2209
Structure
Mol fileKCF fileDB searchJmolKegDraw
Remark
Same as: 
Brite
Lipids [BR:br08002]
 FA  Fatty acyls
  FA01 Fatty Acids and Conjugates
   FA0117 Dicarboxylic acids
    C08261  Nonanedioic acid
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 D DERMATOLOGICALS
  D10 ANTI-ACNE PREPARATIONS
   D10A ANTI-ACNE PREPARATIONS FOR TOPICAL USE
    D10AX Other anti-acne preparations for topical use
     D10AX03 Azelaic acid
      D03034  Azelaic acid (USAN/INN)
USP drug classification [BR:br08302]
 Dermatological Agents
  Azelaic acid
   D03034  Azelaic acid (USAN/INN)
BRITE hierarchy
Other DBs
CAS: 
123-99-9
PubChem: 
ChEBI: 
LIPIDMAPS: 
KNApSAcK: 
PDB-CCD: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        13
            1   C6a C    23.5101  -18.3695
            2   C1b C    24.7143  -19.0733
            3   O6a O    22.2943  -19.0733
            4   O6a O    23.5101  -16.9734
            5   C1b C    25.9243  -18.3695
            6   C1b C    27.1401  -19.0733
            7   C1b C    28.3500  -18.3695
            8   C1b C    29.5599  -19.0733
            9   C1b C    30.7757  -18.3695
            10  C1b C    31.9857  -19.0733
            11  C6a C    33.1899  -18.3695
            12  O6a O    34.4057  -19.0733
            13  O6a O    33.1899  -16.9734
BOND        12
            1     1   2 1
            2     1   3 1
            3     1   4 2
            4     2   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 1
            12   11  13 2

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