COMPOUND: C06306
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Entry
C06306 Compound
Name
(+)-alpha-Pinene;
(1R,5R)-2,6,6-Trimethylbicyclo[3.1.1]hept-2-ene
Formula
C10H16
Exact mass
136.1252
Mol weight
136.23
Structure
Mol file
KCF file
DB search
Reaction
R09974
Enzyme
4.2.3.121
Brite
Lipids [BR:
br08002
]
PR Prenol lipids
PR01 Isoprenoids
PR0102 C10 isoprenoids (monoterpenes)
PR010212 Bicyclic monoterpenoids
C06306 (+)-alpha-Pinene
Phytochemical compounds [BR:
br08003
]
Terpenoids
Monoterpenoids (C10)
Cyclic monoterpenes
C06306 (+)-alpha-Pinene
BRITE hierarchy
Other DBs
CAS:
7785-70-8
PubChem:
8542
ChEBI:
28261
LIPIDMAPS:
LMPR0102120012
KNApSAcK:
C00034999
PDB-CCD:
TMH
[
PDBj
]
NIKKAJI:
J95.399G
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KCF data
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ATOM 10
1 C1y C 25.4100 -16.1700
2 C1z C 25.4100 -17.5700
3 C1x C 24.1500 -16.8700
4 C2y C 24.1500 -15.4700
5 C1y C 24.1500 -18.2700
6 C1a C 26.6000 -16.7300
7 C1a C 26.6700 -18.3400
8 C2x C 22.9600 -16.1700
9 C1a C 24.1500 -14.0700
10 C1x C 22.9600 -17.5700
BOND 11
1 1 2 1
2 1 3 1 #Up
3 1 4 1
4 2 5 1
5 2 6 1
6 2 7 1
7 4 8 2
8 4 9 1
9 5 10 1
10 5 3 1 #Up
11 8 10 1
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