KEGG   DRUG: Acetone
Entry
D02311                      Drug                                   
Name
Acetone (NF);
2-Propanone;
Acetone (TN)
Formula
C3H6O
Exact mass
58.0419
Mol weight
58.08
Structure
Simcomp
Class
Metabolizing enzyme substrate
 DG02855  CYP2E1 substrate
Remark
Same as: C00207
Efficacy
Pharmaceutic aid (solvent)
Metabolism
Enzyme: CYP2E1 [HSA:1571]
Brite
Drug groups [BR:br08330]
 Metabolizing enzyme substrate
  DG02855  CYP2E1 substrate
   D02311  Acetone
Drug metabolizing enzymes and transporters [br08309.html]
 Drug metabolizing enzymes
  D02311
Other DBs
CAS: 67-64-1
PubChem: 7849370
ChEBI: 15347
PDB-CCD: ACN[PDBj]
LigandBox: D02311
NIKKAJI: J2.365E
LinkDB
KCF data

ATOM        4
            1   C5a C    24.6171  -15.7736
            2   C1a C    23.4072  -16.4752
            3   C1a C    25.8269  -16.4752
            4   O5a O    24.6171  -14.3708
BOND        3
            1     1   2 1
            2     1   3 1
            3     1   4 2

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