TQV

O-CRESYL-SALIGENIN PHOSPHATE

Created:	2012-10-03
Last modified:	2024-09-27

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Chemical Details
Formal Charge	0
Atom Count	35
Chiral Atom Count	0
Bond Count	36
Aromatic Bond Count	12

2D diagram of TQV

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Chemical Component Summary
Name	O-CRESYL-SALIGENIN PHOSPHATE
Systematic Name (OpenEye OEToolkits)	(2-hydroxyphenyl)methyl (2-methylphenyl) hydrogen phosphate
Formula	C₁₄ H₁₅ O₅ P
Molecular Weight	294.24
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	O=P(O)(Oc1ccccc1C)OCc2ccccc2O
SMILES	CACTVS	3.385	Cc1ccccc1O[P](O)(=O)OCc2ccccc2O
SMILES	OpenEye OEToolkits	1.9.2	Cc1ccccc1OP(=O)(O)OCc2ccccc2O
Canonical SMILES	CACTVS	3.385	Cc1ccccc1O[P](O)(=O)OCc2ccccc2O
Canonical SMILES	OpenEye OEToolkits	1.9.2	Cc1ccccc1OP(=O)(O)OCc2ccccc2O
InChI	InChI	1.03	InChI=1S/C14H15O5P/c1-11-6-2-5-9-14(11)19-20(16,17)18-10-12-7-3-4-8-13(12)15/h2-9,15H,10H2,1H3,(H,16,17)
InChIKey	InChI	1.03	IZFXZRKTLPZKSA-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	70698418

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