DRUG: Butyl alcohol
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Entry
D03200 Drug
Name
Butyl alcohol (NF);
1-Butanol
Formula
C4H10O
Exact mass
74.0732
Mol weight
74.12
Structure
Mol file
KCF file
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Simcomp
Neighbor
Remark
Same as:
C06142
Efficacy
Pharmaceutic aid (solvent)
Other DBs
CAS:
71-36-3
PubChem:
17397354
ChEBI:
28885
PDB-CCD:
1BO
[
PDBj
]
LigandBox:
D03200
NIKKAJI:
J2.374D
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KCF data
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ATOM 5
1 C1a C 11.7600 -15.2600
2 C1b C 12.9724 -14.5600
3 C1b C 14.1849 -15.2600
4 C1b C 15.3973 -14.5600
5 O1a O 16.6097 -15.2600
BOND 4
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
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