FGM

(2R,3R)-2-hexyl-3-hydroxytridecanoic acid

Created:	2011-11-01
Last modified:	2011-11-01

Find Related PDB Entry
1 entries where FGM is found as a standalone ligand

Find related ligands:

Similar Ligands (Stereospecific) Similar Ligands (including Stereoisomers) Similar Ligands (Quick Screen) Similar Ligands (Substructure Stereospecific) Similar Ligands (Substructure including Stereoisomers)

Chemical Details
Formal Charge	0
Atom Count	60
Chiral Atom Count	2
Bond Count	59
Aromatic Bond Count	0

2D diagram of FGM

Toggle Hydrogen Toggle Labels

Chemical Component Summary
Name	(2R,3R)-2-hexyl-3-hydroxytridecanoic acid
Systematic Name (OpenEye OEToolkits)	(2R,3R)-2-hexyl-3-oxidanyl-tridecanoic acid
Formula	C₁₉ H₃₈ O₃
Molecular Weight	314.503
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	O=C(O)C(CCCCCC)C(O)CCCCCCCCCC
SMILES	CACTVS	3.370	CCCCCCCCCC[CH](O)[CH](CCCCCC)C(O)=O
SMILES	OpenEye OEToolkits	1.7.2	CCCCCCCCCCC(C(CCCCCC)C(=O)O)O
Canonical SMILES	CACTVS	3.370	CCCCCCCCCC[C@@H](O)[C@@H](CCCCCC)C(O)=O
Canonical SMILES	OpenEye OEToolkits	1.7.2	CCCCCCCCCC[C@H]([C@@H](CCCCCC)C(=O)O)O
InChI	InChI	1.03	InChI=1S/C19H38O3/c1-3-5-7-9-10-11-12-14-16-18(20)17(19(21)22)15-13-8-6-4-2/h17-18,20H,3-16H2,1-2H3,(H,21,22)/t17-,18-/m1/s1
InChIKey	InChI	1.03	OYDUHHOWTJLUGL-QZTJIDSGSA-N

Related Resource References

Resource Name	Reference
PubChem	53488435

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.