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FDGlcU

Catalog Number	A18-0088
Category	Fluorescent Enzyme Substrates
Molecular Formula	C13H28O17
Molecular Weight	684.55

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Product Introduction

FDGlcU is a fluorogenic substrate for beta-glucuronidases.

Synonyms	Fluorescein Di-β-D-Glucuronide
IUPAC Name	(2S,3S,4S,5R,6S)-6-[6'-[(2S,3R,4S,5S,6S)-6-carboxy-3,4,5-trihydroxyoxan-2-yl]oxy-3-oxo-5-[(2,3,4,5,6-pentafluorobenzoyl)amino]spiro[2-benzofuran-1,9'-xanthene]-3'-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
Canonical SMILES	C1=CC2=C(C=C1NC(=O)C3=C(C(=C(C(=C3F)F)F)F)F)C(=O)OC24C5=C(C=C(C=C5)OC6C(C(C(C(O6)C(=O)O)O)O)O)OC7=C4C=CC(=C7)OC8C(C(C(C(O8)C(=O)O)O)O)O
InChI	InChI=1S/C39H28F5NO18/c40-20-19(21(41)23(43)24(44)22(20)42)33(52)45-10-1-4-14-13(7-10)36(57)63-39(14)15-5-2-11(58-37-29(50)25(46)27(48)31(61-37)34(53)54)8-17(15)60-18-9-12(3-6-16(18)39)59-38-30(51)26(47)28(49)32(62-38)35(55)56/h1-9,25-32,37-38,46-51H,(H,45,52)(H,53,54)(H,55,56)/t25-,26-,27-,28-,29+,30+,31-,32-,37+,38+/m0/s1
InChIKey	FZYCODLHHHKEGD-JXWZXEQKSA-N
Appearance	Solid Powder

XLogP3	1.6
Hydrogen Bond Donor Count	9
Hydrogen Bond Acceptor Count	23
Rotatable Bond Count	8
Exact Mass	893.12265385 g/mol
Monoisotopic Mass	893.12265385 g/mol
Topological Polar Surface Area	298Å²
Heavy Atom Count	63
Formal Charge	0
Complexity	1650
Isotope Atom Count	0
Defined Atom Stereocenter Count	10
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Publication Number	Title	Priority Date
US-2008176225-A1	Membrane bound reporter gene system	2007-01-18
EP-1337658-B1	A method for the detection of viable microorganisms	2000-11-09
US-2005202523-A1	Method for the detection of viable microorganisms	2000-11-09
US-2003003562-A1	Lactobacillus beta-glucuronidase and DNA encoding the same	2000-05-23
US-6664097-B2	Polynucleotide encoding a Lactobacillus gasseri beta-glucuronidase polypeptide	2000-05-23

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