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CALYCULAGLYCOSIDE-B;4',6'-DI-O-ACETYL-BETA-D-GLUCOPYRANOSE
SpectraBase Compound ID IHZtbqxcI6A
InChI InChI=1S/C30H48O8/c1-19-10-8-11-20(2)14-16-24(15-13-19)21(3)12-9-17-30(6,7)38-29-27(34)26(33)28(36-23(5)32)25(37-29)18-35-22(4)31/h10,12,14,24-29,33-34H,8-9,11,13,15-18H2,1-7H3/b19-10-,20-14-,21-12+/t24-,25-,26-,27-,28-,29+/m0/s1
InChIKey SIBSUOICZHROMU-SMGIZCOTSA-N
Mol Weight 536.7 g/mol
Molecular Formula C30H48O8
Exact Mass 536.334918 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FwhoAKIM1wo
Name CALYCULAGLYCOSIDE-B;4',6'-DI-O-ACETYL-BETA-D-GLUCOPYRANOSE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H48O8
InChI InChI=1S/C30H48O8/c1-19-10-8-11-20(2)14-16-24(15-13-19)21(3)12-9-17-30(6,7)38-29-27(34)26(33)28(36-23(5)32)25(37-29)18-35-22(4)31/h10,12,14,24-29,33-34H,8-9,11,13,15-18H2,1-7H3/b19-10-,20-14-,21-12+/t24-,25-,26-,27-,28-,29+/m0/s1
InChIKey SIBSUOICZHROMU-SMGIZCOTSA-N
Literature Reference Author O.M.COBAR,A.D.RODRIGUEZ,O.L.PADILLA,J.A.SANCHEZ
Literature Reference Citation J.ORG.CHEM.,62,7183(1997)
Literature Reference DOI 10.1021/jo9704725
Molecular Weight 536.706 g/mol
Solvent CDCl3
Source File Reference WANG1906