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GLUCOPYRANOSYL-MENTZEFOLIOL-DECAACETATE
SpectraBase Compound ID G3hErbBd28R
InChI InChI=1S/C41H53ClO25/c1-15(43)53-13-26-31(57-17(3)45)35(61-21(7)49)37(63-23(9)51)40(65-26)56-12-25-11-55-39(29-28(25)33(59-19(5)47)30(42)34(29)60-20(6)48)67-41-38(64-24(10)52)36(62-22(8)50)32(58-18(4)46)27(66-41)14-54-16(2)44/h11,26-41H,12-14H2,1-10H3/t26-,27-,28+,29-,30+,31-,32-,33-,34+,35+,36+,37-,38-,39-,40-,41+/m0/s1
InChIKey KNTJVFLNAPJQGS-PBGYGYALSA-N
Mol Weight 981.3 g/mol
Molecular Formula C41H53ClO25
Exact Mass 980.256445 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DsMybl3QMTl
Name GLUCOPYRANOSYL-MENTZEFOLIOL-DECAACETATE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C41H53ClO25
InChI InChI=1S/C41H53ClO25/c1-15(43)53-13-26-31(57-17(3)45)35(61-21(7)49)37(63-23(9)51)40(65-26)56-12-25-11-55-39(29-28(25)33(59-19(5)47)30(42)34(29)60-20(6)48)67-41-38(64-24(10)52)36(62-22(8)50)32(58-18(4)46)27(66-41)14-54-16(2)44/h11,26-41H,12-14H2,1-10H3/t26-,27-,28+,29-,30+,31-,32-,33-,34+,35+,36+,37-,38-,39-,40-,41+/m0/s1
InChIKey KNTJVFLNAPJQGS-PBGYGYALSA-N
Literature Reference Author B.DINDA,S.DEBNATH,Y.HARIGAYA
Literature Reference Citation CHEM.PHARM.BULL.,55,159(2007)
Literature Reference DOI 10.1248/cpb.55.159
Molecular Weight 981.310 g/mol
Sample ID 37805
Solvent CDCl3