369

5-(4-hydroxyphenoxy)-6-(3-hydroxyphenyl)-7-methylnaphthalen-2-ol

Created:	2008-07-21
Last modified:	2011-06-04

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1 entries where 369 is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	45
Chiral Atom Count	0
Bond Count	48
Aromatic Bond Count	24

2D diagram of 369

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Chemical Component Summary
Name	5-(4-hydroxyphenoxy)-6-(3-hydroxyphenyl)-7-methylnaphthalen-2-ol
Systematic Name (OpenEye OEToolkits)	5-(4-hydroxyphenoxy)-6-(3-hydroxyphenyl)-7-methyl-naphthalen-2-ol
Formula	C₂₃ H₁₈ O₄
Molecular Weight	358.387
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	O(c2c(c1cccc(O)c1)c(cc3c2ccc(O)c3)C)c4ccc(O)cc4
SMILES	CACTVS	3.341	Cc1cc2cc(O)ccc2c(Oc3ccc(O)cc3)c1c4cccc(O)c4
SMILES	OpenEye OEToolkits	1.5.0	Cc1cc2cc(ccc2c(c1c3cccc(c3)O)Oc4ccc(cc4)O)O
Canonical SMILES	CACTVS	3.341	Cc1cc2cc(O)ccc2c(Oc3ccc(O)cc3)c1c4cccc(O)c4
Canonical SMILES	OpenEye OEToolkits	1.5.0	Cc1cc2cc(ccc2c(c1c3cccc(c3)O)Oc4ccc(cc4)O)O
InChI	InChI	1.03	InChI=1S/C23H18O4/c1-14-11-16-13-19(26)7-10-21(16)23(27-20-8-5-17(24)6-9-20)22(14)15-3-2-4-18(25)12-15/h2-13,24-26H,1H3
InChIKey	InChI	1.03	OKUBOIRIRQHVSM-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	24892830

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.