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HYEMALOSIDE_C

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HYEMALOSIDE_C
SpectraBase Compound ID 66hhBGO5IZH
InChI InChI=1S/C40H30O23/c41-14-1-3-15(4-2-14)59-40-35(63-37(55)13-7-20(44)28(49)21(45)8-13)34(62-36(54)12-5-18(42)27(48)19(43)6-12)33-24(60-40)11-58-38(56)16-9-22(46)29(50)31(52)25(16)26-17(39(57)61-33)10-23(47)30(51)32(26)53/h1-10,24,33-35,40-53H,11H2/t24-,33-,34+,35-,40-/m1/s1
InChIKey BIUWKTLZFMHRQE-RYQQTUIDSA-N
Mol Weight 878.7 g/mol
Molecular Formula C40H30O23
Exact Mass 878.117787 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9YBgS3bjBbb
Name HYEMALOSIDE_C
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H30O23
InChI InChI=1S/C40H30O23/c41-14-1-3-15(4-2-14)59-40-35(63-37(55)13-7-20(44)28(49)21(45)8-13)34(62-36(54)12-5-18(42)27(48)19(43)6-12)33-24(60-40)11-58-38(56)16-9-22(46)29(50)31(52)25(16)26-17(39(57)61-33)10-23(47)30(51)32(26)53/h1-10,24,33-35,40-53H,11H2/t24-,33-,34+,35-,40-/m1/s1
InChIKey BIUWKTLZFMHRQE-RYQQTUIDSA-N
Literature Reference Author H.R.BOKESCH,A.WAMIRU,S.F.J.L.GRICE,J.A.BEUTLER,T.C.MCKEE,J.B .MCMAHON
Literature Reference Citation J.NAT.PROD.,71,1634(2008)
Literature Reference DOI 10.1021/np8002518
Molecular Weight 878.664 g/mol
Sample ID 29080
Solvent CD3OD