COMPOUND: C02001
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Entry
C02001 Compound
Name
Allyl alcohol;
2-Propen-1-ol
Formula
C3H6O
Exact mass
58.0419
Mol weight
58.08
Structure
Mol file
KCF file
DB search
Reaction
R03572
Enzyme
1.1.1.54
Brite
Pesticides [BR:
br08007
]
Pesticides
Herbicides
Others
C02001 Allyl alcohol
BRITE hierarchy
Other DBs
CAS:
107-18-6
PubChem:
5097
ChEBI:
16605
PDB-CCD:
5VQ
[
PDBj
]
NIKKAJI:
J4.059B
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KCF data
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ATOM 4
1 C2b C 15.9147 -14.9077
2 C1b C 17.1253 -14.2123
3 C2a C 14.6974 -14.2123
4 O1a O 18.3426 -14.9077
BOND 3
1 1 2 1
2 1 3 2
3 2 4 1
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