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Asiaticoside
SpectraBase Compound ID 1K8UUGFWQlY
InChI InChI=1S/C48H78O19/c1-20-10-13-48(15-14-46(6)23(29(48)21(20)2)8-9-28-44(4)16-24(51)39(60)45(5,19-50)27(44)11-12-47(28,46)7)43(61)67-42-36(58)33(55)31(53)26(65-42)18-62-40-37(59)34(56)38(25(17-49)64-40)66-41-35(57)32(54)30(52)22(3)63-41/h8,20-22,24-42,49-60H,9-19H2,1-7H3/t20-,21+,22-,24-,25-,26-,27?,28?,29?,30-,31-,32+,33+,34-,35+,36-,37-,38-,39+,40-,41-,42+,44+,45+,46-,47-,48+/m1/s1
InChIKey WYQVAPGDARQUBT-BJFPQIDASA-N
Mol Weight 959.1 g/mol
Molecular Formula C48H78O19
Exact Mass 958.51373 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8fVrrUJt8Ts
Name ASIATICOSIDE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C48H78O19
InChI InChI=1S/C48H78O19/c1-20-10-13-48(15-14-46(6)23(29(48)21(20)2)8-9-28-44(4)16-24(51)39(60)45(5,19-50)27(44)11-12-47(28,46)7)43(61)67-42-36(58)33(55)31(53)26(65-42)18-62-40-37(59)34(56)38(25(17-49)64-40)66-41-35(57)32(54)30(52)22(3)63-41/h8,20-22,24-42,49-60H,9-19H2,1-7H3/t20-,21+,22-,24-,25-,26-,27?,28?,29?,30-,31-,32+,33+,34-,35+,36-,37-,38-,39+,40-,41-,42+,44+,45+,46-,47-,48+/m1/s1
InChIKey WYQVAPGDARQUBT-BJFPQIDASA-N
Literature Reference Author S.B.MAHATO,N.P.SAHU,P.LUGER,E.MUELLER
Literature Reference Citation J.CHEM.SOC.PERKIN-2,1509(1987)
Literature Reference DOI 10.1039/p29870001509
Molecular Weight 959.136 g/mol
Solvent PYRIDINE-D5
Source File Reference UWBK67