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(22S,25R)-4-BETA,16-BETA-DIACETOXY-22,26-N-CBZ-EPIMINO-5-ALPHA-CHOLESTAN-3-BETA-OL
SpectraBase Compound ID 9xWT9EVG2LA
InChI InChI=1S/C39H57NO7/c1-23-12-15-32(40(21-23)37(44)45-22-27-10-8-7-9-11-27)24(2)35-34(46-25(3)41)20-31-28-13-14-30-36(47-26(4)42)33(43)17-19-38(30,5)29(28)16-18-39(31,35)6/h7-11,23-24,28-36,43H,12-22H2,1-6H3/t23-,24-,28-,29+,30+,31+,32-,33+,34+,35+,36-,38-,39+/m1/s1
InChIKey BSEGLXMNUYTOEN-DFNFTMGKSA-N
Mol Weight 651.9 g/mol
Molecular Formula C39H57NO7
Exact Mass 651.413503 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Djkf4jCDefX
Name (22S,25R)-4-BETA,16-BETA-DIACETOXY-22,26-N-CBZ-EPIMINO-5-ALPHA-CHOLESTAN-3-BETA-OL
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C39H57NO7
InChI InChI=1S/C39H57NO7/c1-23-12-15-32(40(21-23)37(44)45-22-27-10-8-7-9-11-27)24(2)35-34(46-25(3)41)20-31-28-13-14-30-36(47-26(4)42)33(43)17-19-38(30,5)29(28)16-18-39(31,35)6/h7-11,23-24,28-36,43H,12-22H2,1-6H3/t23-,24-,28-,29+,30+,31+,32-,33+,34+,35+,36-,38-,39+/m1/s1
InChIKey BSEGLXMNUYTOEN-DFNFTMGKSA-N
Literature Reference Author E.VILORIA,G.MECCIA,A.N.USUBILLAGA
Literature Reference Citation J.NAT.PROD.,55,1178(1992)
Literature Reference DOI 10.1021/np50087a003
Molecular Weight 651.884 g/mol
Solvent CDCl3
Source File Reference UWTS434