FIP

5-FLUOROINDOLE PROPANOL PHOSPHATE

Created:	1999-07-08
Last modified:	2011-06-04

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3 entries where FIP is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	31
Chiral Atom Count	0
Bond Count	32
Aromatic Bond Count	10

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Chemical Component Summary
Name	5-FLUOROINDOLE PROPANOL PHOSPHATE
Systematic Name (OpenEye OEToolkits)	3-(5-fluoro-1H-indol-3-yl)propyl dihydrogen phosphate
Formula	C₁₁ H₁₃ F N O₄ P
Molecular Weight	273.197
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	Fc1cc2c(cc1)ncc2CCCOP(=O)(O)O
SMILES	CACTVS	3.341	O[P](O)(=O)OCCCc1c[nH]c2ccc(F)cc12
SMILES	OpenEye OEToolkits	1.5.0	c1cc2c(cc1F)c(c[nH]2)CCCOP(=O)(O)O
Canonical SMILES	CACTVS	3.341	O[P](O)(=O)OCCCc1c[nH]c2ccc(F)cc12
Canonical SMILES	OpenEye OEToolkits	1.5.0	c1cc2c(cc1F)c(c[nH]2)CCCOP(=O)(O)O
InChI	InChI	1.03	InChI=1S/C11H13FNO4P/c12-9-3-4-11-10(6-9)8(7-13-11)2-1-5-17-18(14,15)16/h3-4,6-7,13H,1-2,5H2,(H2,14,15,16)
InChIKey	InChI	1.03	YVYGGBFCYXRNKM-UHFFFAOYSA-N

Drug Info: DrugBank

DrugBank ID	DB07773
Name	5-FLUOROINDOLE PROPANOL PHOSPHATE
Groups	experimental
Synonyms	5-FLUOROINDOLE PROPANOL 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