OYA

OCTANAL

Created:	2007-07-09
Last modified:	2024-09-27

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4 entries where OYA is found as a standalone ligand1 entries where OYA is covalently linked to polymer or other heterogen groups

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Chemical Details
Formal Charge	0
Atom Count	25
Chiral Atom Count	0
Bond Count	24
Aromatic Bond Count	0

2D diagram of OYA

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Chemical Component Summary
Name	OCTANAL
Synonyms	OCTYL ALDEHYDE
Systematic Name (OpenEye OEToolkits)	octanal
Formula	C₈ H₁₆ O
Molecular Weight	128.212
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	O=CCCCCCCC
SMILES	CACTVS	3.341	CCCCCCCC=O
SMILES	OpenEye OEToolkits	1.5.0	CCCCCCCC=O
Canonical SMILES	CACTVS	3.341	CCCCCCCC=O
Canonical SMILES	OpenEye OEToolkits	1.5.0	CCCCCCCC=O
InChI	InChI	1.03	InChI=1S/C8H16O/c1-2-3-4-5-6-7-8-9/h8H,2-7H2,1H3
InChIKey	InChI	1.03	NUJGJRNETVAIRJ-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	454
ChEMBL	CHEMBL18407
ChEBI	CHEBI:17935

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.