KEGG   COMPOUND: C16521
Entry
C16521                      Compound                               
Name
Isoprene;
2-Methyl-1,3-butadiene
Formula
C5H8
Exact mass
68.0626
Mol weight
68.117
Structure
Reaction
R08199
Pathway
map00900  Terpenoid backbone biosynthesis
map01062  Biosynthesis of terpenoids and steroids
map01110  Biosynthesis of secondary metabolites
Enzyme
4.2.3.27
Brite
Phytochemical compounds [BR:br08003]
 Terpenoids
  Hemiterpenoids (C5)
   C16521  Isoprene
Other DBs
CAS: 78-79-5
PubChem: 51090850
ChEBI: 35194
KNApSAcK: C00046784
PDB-CCD: 61G[PDBj]
NIKKAJI: J1.958E
LinkDB
KCF data

ATOM        5
            1   C2c C    12.3200  -11.0600
            2   C2b C    13.5324  -11.7600
            3   C2a C    11.1076  -11.7600
            4   C1a C    12.3200   -9.6600
            5   C2a C    14.7279  -11.0696
BOND        4
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 2

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