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Secondary metabolite: 6-Hydroxy-1h-indole-3-carbaldehyde
Summary
Physicochemical properties
Drug-likeness properties
ADMET properties
Descriptors
Summary
Molecular formula:
C9H7NO2
SMILES:
O=Cc1c[nH]c2c1ccc(c2)O
InChI:
InChI=1S/C9H7NO2/c11-5-6-4-10-9-3-7(12)1-2-8(6)9/h1-5,10,12H
InChIKey:
FAFBOYSDWMRMLQ-UHFFFAOYSA-N
Molecular scaffolds
Scaffold Graph/Node/Bond level:
c1ccc2[nH]ccc2c1
Scaffold Graph/Node level:
C1CCC2NCCC2C1
Scaffold Graph level:
C1CCC2CCCC2C1
Chemical classification
Kingdom:
Organic compounds
Super class:
Organoheterocyclic compounds
Class:
Indoles and derivatives
Sub class:
Hydroxyindoles
Synonymous chemical names:
6-hydroxy-1h-indole-3-carbaldehyde
External chemical identifiers:
CID_10103438
;
CAS_192184-71-7
;
NPATLAS_NPA017051
;
CHEMSPIDER_8278966
;
ZINC_ZINC000014455605
;
Molport_MolPort-006-826-386
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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