T4T

2-tetradecylsulfanylethanoic acid

Created:	2018-07-10
Last modified:	2020-11-11

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2 entries where T4T is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	51
Chiral Atom Count	0
Bond Count	50
Aromatic Bond Count	0

2D diagram of T4T

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Chemical Component Summary
Name	2-tetradecylsulfanylethanoic acid
Systematic Name (OpenEye OEToolkits)	2-tetradecylsulfanylethanoic acid
Formula	C₁₆ H₃₂ O₂ S
Molecular Weight	288.489
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	CCCCCCCCCCCCCCSCC(O)=O
SMILES	OpenEye OEToolkits	2.0.6	CCCCCCCCCCCCCCSCC(=O)O
Canonical SMILES	CACTVS	3.385	CCCCCCCCCCCCCCSCC(O)=O
Canonical SMILES	OpenEye OEToolkits	2.0.6	CCCCCCCCCCCCCCSCC(=O)O
InChI	InChI	1.03	InChI=1S/C16H32O2S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-19-15-16(17)18/h2-15H2,1H3,(H,17,18)
InChIKey	InChI	1.03	IPBCWPPBAWQYOO-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	114924
ChEMBL	CHEMBL187734
ChEBI	CHEBI:94633

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.