KEGG   COMPOUND: C09633Help
Entry
C09633                      Compound                               

Name
Chamazulene
Formula
C14H16
Exact mass
184.1252
Mol weight
184.2768
Structure
Mol fileKCF fileDB search
Brite
Lipids [BR:br08002]
 PR  Prenol Lipids
  PR01 Isoprenoids
   PR0103 C15 isoprenoids (sesquiterpenes)
    PR010341 Guaiane sesquiterpenoids
     C09633  Chamazulene
Phytochemical compounds [BR:br08003]
 Terpenoids
  Sesquiterpenoids (C15)
   Others
    C09633  Chamazulene
Major components of natural products [BR:br08323]
 Medicinal herbs
  German chamomile
   C09633  Chamazulene
BRITE hierarchy
Other DBs
CAS: 529-05-5
PubChem: 11823
ChEBI: 3573
ChEMBL: CHEMBL495665
LIPIDMAPS: LMPR0103410002
KNApSAcK: C00003114
3DMET: B03147
NIKKAJI: J9.436F
LinkDB All DBs
KCF data Show

ATOM        14
            1   C8y C    27.4400   -8.6800
            2   C8y C    26.6000   -7.4900
            3   C8y C    26.9500   -6.1600
            4   C8x C    28.2800   -5.5300
            5   C8x C    28.9100   -8.6800
            6   C8y C    29.4700   -6.1600
            7   C8x C    29.7500   -7.5600
            8   C8y C    25.7600   -5.3900
            9   C8x C    24.7100   -6.3000
            10  C8x C    25.2000   -7.4900
            11  C1a C    26.7400   -9.9400
            12  C1a C    25.7600   -3.9900
            13  C1b C    30.6600   -5.3200
            14  C1a C    31.8500   -6.0200
BOND        15
            1     3   4 2
            2     1   5 2
            3     4   6 1
            4     2   3 1
            5     5   7 1
            6     1   2 1
            7     6   7 2
            8     3   8 1
            9     8   9 2
            10    9  10 1
            11    2  10 2
            12    1  11 1
            13    8  12 1
            14    6  13 1
            15   13  14 1

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