(1R,2S,4S,5S)-ACETIC-ACID-4-(2-CHLORO-6-METHYLAMINO-PURIN-9-YL)-2-PHOSPHONOOXY-BICYCLO-[3.1.0]-HEX-1-YL-METHYLESTER

SpectraBase Compound ID	4SAxbsTZecO
InChI	InChI=1S/C15H19ClN5O6P/c1-7(22)26-5-15-4-8(15)9(3-10(15)27-28(23,24)25)21-6-18-11-12(17-2)19-14(16)20-13(11)21/h6,8-10H,3-5H2,1-2H3,(H,17,19,20)(H2,23,24,25)/t8-,9+,10+,15-/m1/s1
InChIKey	QCAPBWBCTSUZSO-TURATIMXSA-N Google Search
Mol Weight	431.77 g/mol
Molecular Formula	C15H19ClN5O6P
Exact Mass	431.076148 g/mol

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SpectraBase Spectrum ID	BZCixMpQzym
Name	(1R,2S,4S,5S)-ACETIC-ACID-4-(2-CHLORO-6-METHYLAMINO-PURIN-9-YL)-2-PHOSPHONOOXY-BICYCLO-[3.1.0]-HEX-1-YL-METHYLESTER
Compound Number	9
Copyright	Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula	C15H17ClN5O6P
InChI	InChI=1S/C15H19ClN5O6P/c1-7(22)26-5-15-4-8(15)9(3-10(15)27-28(23,24)25)21-6-18-11-12(17-2)19-14(16)20-13(11)21/h6,8-10H,3-5H2,1-2H3,(H,17,19,20)(H2,23,24,25)/t8-,9+,10+,15-/m1/s1
InChIKey	QCAPBWBCTSUZSO-TURATIMXSA-N
Literature Reference Author	B.XU,A.STEPHENS,G.KRISCHENHEUTER,A.F.GRESLIN,X.CHENG,J.SENNE LO,M.CATTANEO,M.L.ZI
Literature Reference Citation	J.MED.CHEM.,45,5694(2002)
Literature Reference DOI	10.1021/jm020173u
Solvent	D2O
Source File Reference	UWLU65707