(3AS,4R,5R,6S,6AS)-4-ACETOXY-6-[(BENZYLOXY)-METHYL]-2-(DIMETHYLAMIO)-3A,5,6,6A-TETRAHYDRO-4H-CYCLOPENTOXAZOL-5-YL-2-ACETAMIDO-4-O-(2-ACETAMIDO)-3-O-BENZYL-4,6-

SpectraBase Compound ID	IpoygoCGG5W
InChI	InChI=1S/C62H72N4O15/c1-38(67)63-50-56(72-33-43-25-15-8-16-26-43)54(80-61-51(64-39(2)68)57(73-34-44-27-17-9-18-28-44)55-48(77-61)37-74-59(79-55)45-29-19-10-20-30-45)47(36-71-32-42-23-13-7-14-24-42)76-60(50)78-53-46(35-70-31-41-21-11-6-12-22-41)52-49(58(53)75-40(3)69)65-62(81-52)66(4)5/h6-30,46-61H,31-37H2,1-5H3,(H,63,67)(H,64,68)/t46-,47+,48-,49-,50+,51-,52-,53+,54+,55-,56-,57+,58+,59-,60-,61+/m1/s1
InChIKey	RGHCGBBMNHSSIF-RQODWMGCSA-N Google Search
Mol Weight	1113.3 g/mol
Molecular Formula	C62H72N4O15
Exact Mass	1112.499418 g/mol

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SpectraBase Spectrum ID	1WFQIk00v3W
Name	(3AS,4R,5R,6S,6AS)-4-ACETOXY-6-[(BENZYLOXY)-METHYL]-2-(DIMETHYLAMIO)-3A,5,6,6A-TETRAHYDRO-4H-CYCLOPENTOXAZOL-5-YL-2-ACETAMIDO-4-O-(2-ACETAMIDO)-3-O-BENZYL-4,6-
Copyright	Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula	C62H72N4O15
InChI	InChI=1S/C62H72N4O15/c1-38(67)63-50-56(72-33-43-25-15-8-16-26-43)54(80-61-51(64-39(2)68)57(73-34-44-27-17-9-18-28-44)55-48(77-61)37-74-59(79-55)45-29-19-10-20-30-45)47(36-71-32-42-23-13-7-14-24-42)76-60(50)78-53-46(35-70-31-41-21-11-6-12-22-41)52-49(58(53)75-40(3)69)65-62(81-52)66(4)5/h6-30,46-61H,31-37H2,1-5H3,(H,63,67)(H,64,68)/t46-,47+,48-,49-,50+,51-,52-,53+,54+,55-,56-,57+,58+,59-,60-,61+/m1/s1
InChIKey	RGHCGBBMNHSSIF-RQODWMGCSA-N
Literature Reference Author	J.L.MALOISEL,A.VASELLA,B.M.TROST,D.L.VANVRANKEN
Literature Reference Citation	HELV.CHIM.ACTA,75,1515(1992)
Literature Reference DOI	10.1002/hlca.19920750506
Molecular Weight	1113.271 g/mol
Solvent	CDCl3
Source File Reference	UWCS8682