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Secondary metabolite: Pinicoloform
Summary
Physicochemical properties
Drug-likeness properties
ADMET properties
Descriptors
Summary
Molecular formula:
C11H13Cl3O2
SMILES:
CCC/C=C/C=CC(=CC(=O)C(Cl)(Cl)Cl)O
InChI:
InChI=1S/C11H13Cl3O2/c1-2-3-4-5-6-7-9(15)8-10(16)11(12,13)14/h4-8,15H,2-3H2,1H3/b5-4+,7-6-,9-8?
InChIKey:
LHYGLTHVDSAHBL-ZFTCAJEOSA-N
Chemical classification
Kingdom:
Organic compounds
Super class:
Organic oxygen compounds
Class:
Organooxygen compounds
Sub class:
Carbonyl compounds
Synonymous chemical names:
pinicoloform
External chemical identifiers:
CID_139583996
;
NPATLAS_NPA003223
;
CHEMSPIDER_78436094
Chemical structure download
2D:
2D MOL
2D MOL2
2D SDF
3D:
3D MOL
3D MOL2
3D SDF
3D PDB
3D PDBQT
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