KEGG   COMPOUND: C01841
Entry
C01841                      Compound                               

Name
Pentalenene
Formula
C15H24
Exact mass
204.1878
Mol weight
204.3511
Structure
Reaction
Pathway
map00909  Sesquiterpenoid and triterpenoid biosynthesis
map00999  Biosynthesis of various secondary metabolites - part 1
map01100  Metabolic pathways
map01110  Biosynthesis of secondary metabolites
Module
M00819  Pentalenolactone biosynthesis, farnesyl-PP => pentalenolactone
Enzyme
1.14.15.32      4.2.3.7
Brite
Lipids [BR:br08002]
 PR  Prenol lipids
  PR01 Isoprenoids
   PR0103 C15 isoprenoids (sesquiterpenes)
    PR010374 Pentalenane sesquiterpenoids
     C01841  Pentalenene
Phytochemical compounds [BR:br08003]
 Terpenoids
  Sesquiterpenoids (C15)
   Humulenes
    C01841  Pentalenene
Other DBs
CAS: 73306-73-7
PubChem: 4959
ChEBI: 17251
KNApSAcK: C00021799
NIKKAJI: J137.919D
KCF data

ATOM        15
            1   C1z C    26.8280  -17.3137
            2   C1y C    27.9613  -18.1257
            3   C1y C    27.2662  -15.9757
            4   C1x C    25.4316  -17.3020
            5   C1y C    25.7003  -18.1374
            6   C2y C    29.0948  -17.3077
            7   C1x C    27.5349  -19.4635
            8   C1x C    26.1327  -15.1520
            9   C2x C    28.6624  -15.9757
            10  C1z C    24.9935  -15.9757
            11  C1x C    26.1386  -19.4694
            12  C1a C    24.3683  -17.7108
            13  C1a C    30.4268  -17.7401
            14  C1a C    23.6383  -15.1289
            15  C1a C    23.6381  -16.3320
BOND        17
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     1   5 1
            5     2   6 1
            6     2   7 1
            7     3   8 1
            8     3   9 1
            9     4  10 1
            10    5  11 1
            11    5  12 1 #Up
            12    6  13 1
            13   10  14 1
            14   10  15 1
            15    6   9 2
            16    7  11 1
            17    8  10 1

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