F19

2-[(2-NAPHTHYLSULFONYL)AMINO]ETHYL DIHYDROGEN PHOSPHATE

Created:	2006-04-27
Last modified:	2011-06-04

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2 entries where F19 is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	35
Chiral Atom Count	0
Bond Count	36
Aromatic Bond Count	11

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Chemical Component Summary
Name	2-[(2-NAPHTHYLSULFONYL)AMINO]ETHYL DIHYDROGEN PHOSPHATE
Systematic Name (OpenEye OEToolkits)	2-(naphthalen-2-ylsulfonylamino)ethyl dihydrogen phosphate
Formula	C₁₂ H₁₄ N O₆ P S
Molecular Weight	331.281
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	O=P(O)(O)OCCNS(=O)(=O)c2ccc1c(cccc1)c2
SMILES	CACTVS	3.341	O[P](O)(=O)OCCN[S](=O)(=O)c1ccc2ccccc2c1
SMILES	OpenEye OEToolkits	1.5.0	c1ccc2cc(ccc2c1)S(=O)(=O)NCCOP(=O)(O)O
Canonical SMILES	CACTVS	3.341	O[P](O)(=O)OCCN[S](=O)(=O)c1ccc2ccccc2c1
Canonical SMILES	OpenEye OEToolkits	1.5.0	c1ccc2cc(ccc2c1)S(=O)(=O)NCCOP(=O)(O)O
InChI	InChI	1.03	InChI=1S/C12H14NO6PS/c14-20(15,16)19-8-7-13-21(17,18)12-6-5-10-3-1-2-4-11(10)9-12/h1-6,9,13H,7-8H2,(H2,14,15,16)
InChIKey	InChI	1.03	FCROUVVWZFPGFM-UHFFFAOYSA-N

Drug Info: DrugBank

DrugBank ID	DB07732
Name	2-[(2-NAPHTHYLSULFONYL)AMINO]ETHYL DIHYDROGEN PHOSPHATE
Groups	experimental
Synonyms	2-[(2-NAPHTHYLSULFONYL)AMINO]ETHYL DIHYDROGEN PHOSPHATE

Drug Targets

Name	Target Sequence	Pharmacological Action	Actions
Tryptophan synthase alpha chain	MERYENLFAQLNDRREGAFVPFVTLGDPGIEQSLKIIDTLIDAGADALEL...	unknown
Tryptophan synthase beta chain	MTTLLNPYFGEFGGMYVPQILMPALNQLEEAFVSAQKDPEFQAQFADLLK...	unknown

Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682