KEGG   COMPOUND: C09625Help
Entry
C09625                      Compound                               

Name
beta-Cadinene
Formula
C15H24
Exact mass
204.1878
Mol weight
204.3511
Structure
Mol fileKCF fileDB search
Brite
Lipids [BR:br08002]
 PR  Prenol Lipids
  PR01 Isoprenoids
   PR0103 C15 isoprenoids (sesquiterpenes)
    PR010333 Cadinane sesquiterpenoids
     C09625  beta-Cadinene
Phytochemical compounds [BR:br08003]
 Terpenoids
  Sesquiterpenoids (C15)
   Cadinanes
    C09625  beta-Cadinene
BRITE hierarchy
Other DBs
CAS: 523-47-7
PubChem: 11815
ChEBI: 27723
ChEMBL: CHEMBL3120653
LIPIDMAPS: LMPR0103330003
KNApSAcK: C00003106
3DMET: B03140
NIKKAJI: J6.632J
KCF data Show

ATOM        15
            1   C1y C    27.7900  -17.8500
            2   C1y C    27.7900  -19.2500
            3   C1y C    26.6000  -17.1500
            4   C1x C    28.9800  -17.1500
            5   C2y C    26.6000  -19.9500
            6   C1x C    28.9800  -19.9500
            7   C1x C    25.3400  -17.8500
            8   C1c C    26.6000  -15.7500
            9   C2y C    30.2400  -17.8500
            10  C2x C    25.3400  -19.2500
            11  C1a C    26.6000  -21.3500
            12  C2x C    30.2400  -19.2500
            13  C1a C    27.7900  -15.0500
            14  C1a C    25.4100  -15.0500
            15  C1a C    31.4300  -17.1500
BOND        16
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 1
            7     3   8 1 #Up
            8     4   9 1
            9     5  10 2
            10    5  11 1
            11    6  12 1
            12    8  13 1
            13    8  14 1
            14    9  15 1
            15    7  10 1
            16    9  12 2

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