Q0X

(Z)-3-[3,4-bis(oxidanyl)phenyl]-2-oxidanyl-1-[2,4,6-tris(oxidanyl)phenyl]prop-2-en-1-one

Created:	2022-10-06
Last modified:	2022-12-31

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1 entries where Q0X is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	34
Chiral Atom Count	0
Bond Count	35
Aromatic Bond Count	12

2D diagram of Q0X

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Chemical Component Summary
Name	(Z)-3-[3,4-bis(oxidanyl)phenyl]-2-oxidanyl-1-[2,4,6-tris(oxidanyl)phenyl]prop-2-en-1-one
Synonyms	taxifolin chalcone
Systematic Name (OpenEye OEToolkits)	(~{Z})-3-[3,4-bis(oxidanyl)phenyl]-2-oxidanyl-1-[2,4,6-tris(oxidanyl)phenyl]prop-2-en-1-one
Formula	C₁₅ H₁₂ O₇
Molecular Weight	304.252
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	Oc1cc(O)c(c(O)c1)C(=O)C(O)=Cc2ccc(O)c(O)c2
SMILES	OpenEye OEToolkits	2.0.7	c1cc(c(cc1C=C(C(=O)c2c(cc(cc2O)O)O)O)O)O
Canonical SMILES	CACTVS	3.385	Oc1cc(O)c(c(O)c1)C(=O)/C(O)=C/c2ccc(O)c(O)c2
Canonical SMILES	OpenEye OEToolkits	2.0.7	c1cc(c(cc1/C=C(/C(=O)c2c(cc(cc2O)O)O)\O)O)O
InChI	InChI	1.06	InChI=1S/C15H12O7/c16-8-5-11(19)14(12(20)6-8)15(22)13(21)4-7-1-2-9(17)10(18)3-7/h1-6,16-21H/b13-4-
InChIKey	InChI	1.06	CUYYQQQQHCDPCX-PQMHYQBVSA-N

Related Resource References

Resource Name	Reference
PubChem	60112525

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.