8MJ

8-oxidanylquinoline-2-carbaldehyde

Created:	2021-10-28
Last modified:	2022-08-22

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1 entries where 8MJ is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	20
Chiral Atom Count	0
Bond Count	21
Aromatic Bond Count	11

2D diagram of 8MJ

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Chemical Component Summary
Name	8-oxidanylquinoline-2-carbaldehyde
Systematic Name (OpenEye OEToolkits)	8-oxidanylquinoline-2-carbaldehyde
Formula	C₁₀ H₇ N O₂
Molecular Weight	173.168
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	Oc1cccc2ccc(C=O)nc12
SMILES	OpenEye OEToolkits	2.0.7	c1cc2ccc(nc2c(c1)O)C=O
Canonical SMILES	CACTVS	3.385	Oc1cccc2ccc(C=O)nc12
Canonical SMILES	OpenEye OEToolkits	2.0.7	c1cc2ccc(nc2c(c1)O)C=O
InChI	InChI	1.06	InChI=1S/C10H7NO2/c12-6-8-5-4-7-2-1-3-9(13)10(7)11-8/h1-6,13H
InChIKey	InChI	1.06	SLBPIHCMXPQAIQ-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	599342
ChEMBL	CHEMBL2321986
ChEBI	CHEBI:183895

RCSB PDB Core Operations are funded by the U.S. National Science Foundation (DBI-2321666), the US Department of Energy (DE-SC0019749), and the National Cancer Institute, National Institute of Allergy and Infectious Diseases, and National Institute of General Medical Sciences of the National Institutes of Health under grant R01GM157729.