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Secondary metabolite: Gallicynoic acid I
Summary
Physicochemical properties
Drug-likeness properties
ADMET properties
Descriptors
Summary
Molecular formula:
C10H16O3
SMILES:
CCCCC(C#CCCC(=O)O)O
InChI:
InChI=1S/C10H16O3/c1-2-3-6-9(11)7-4-5-8-10(12)13/h9,11H,2-3,5-6,8H2,1H3,(H,12,13)
InChIKey:
DPGVHXHAHQPSNB-UHFFFAOYSA-N
Chemical classification
Kingdom:
Organic compounds
Super class:
Organic acids and derivatives
Class:
Hydroxy acids and derivatives
Sub class:
Medium-chain hydroxy acids and derivatives
Synonymous chemical names:
gallicynoic acid i
External chemical identifiers:
CID_24800196
;
NPATLAS_NPA012053
;
CHEMSPIDER_78435677
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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