W1G

2-PHENOXY-5-(2-PROPENYL)PHENOL

Created:	2013-05-15
Last modified:	2014-09-05

Find Related PDB Entry
1 entries where W1G 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	31
Chiral Atom Count	0
Bond Count	32
Aromatic Bond Count	12

2D diagram of W1G

Toggle Hydrogen Toggle Labels

Chemical Component Summary
Name	2-PHENOXY-5-(2-PROPENYL)PHENOL
Systematic Name (OpenEye OEToolkits)	2-phenoxy-5-prop-2-enyl-phenol
Formula	C₁₅ H₁₄ O₂
Molecular Weight	226.27
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	O(c1ccccc1)c2ccc(cc2O)C\C=C
SMILES	CACTVS	3.385	Oc1cc(CC=C)ccc1Oc2ccccc2
SMILES	OpenEye OEToolkits	1.9.2	C=CCc1ccc(c(c1)O)Oc2ccccc2
Canonical SMILES	CACTVS	3.385	Oc1cc(CC=C)ccc1Oc2ccccc2
Canonical SMILES	OpenEye OEToolkits	1.9.2	C=CCc1ccc(c(c1)O)Oc2ccccc2
InChI	InChI	1.03	InChI=1S/C15H14O2/c1-2-6-12-9-10-15(14(16)11-12)17-13-7-4-3-5-8-13/h2-5,7-11,16H,1,6H2
InChIKey	InChI	1.03	DBZGFSBCPYRHRA-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	71464708

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.