7UE

5-pyrrol-1-ylpyridine-3-carboxylic acid

Created:	2021-09-01
Last modified:	2022-09-07

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1 entries where 7UE is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	22
Chiral Atom Count	0
Bond Count	23
Aromatic Bond Count	11

2D diagram of 7UE

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Chemical Component Summary
Name	5-pyrrol-1-ylpyridine-3-carboxylic acid
Systematic Name (OpenEye OEToolkits)	5-pyrrol-1-ylpyridine-3-carboxylic acid
Formula	C₁₀ H₈ N₂ O₂
Molecular Weight	188.183
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	OC(=O)c1cncc(c1)n2cccc2
SMILES	OpenEye OEToolkits	2.0.7	c1ccn(c1)c2cc(cnc2)C(=O)O
Canonical SMILES	CACTVS	3.385	OC(=O)c1cncc(c1)n2cccc2
Canonical SMILES	OpenEye OEToolkits	2.0.7	c1ccn(c1)c2cc(cnc2)C(=O)O
InChI	InChI	1.03	InChI=1S/C10H8N2O2/c13-10(14)8-5-9(7-11-6-8)12-3-1-2-4-12/h1-7H,(H,13,14)
InChIKey	InChI	1.03	MBHJQDUXANKYCO-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	2050101

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