SpectraBase Compound ID | LWaGqIiZki1 |
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InChI | InChI=1S/C35H46O20/c1-14-24(43)26(45)28(47)33(50-14)54-31-30(53-23(42)7-4-15-2-5-17(38)19(40)10-15)22(13-37)52-35(49-9-8-16-3-6-18(39)20(41)11-16)32(31)55-34-29(48)27(46)25(44)21(12-36)51-34/h2-7,10-11,14,21-22,24-41,43-48H,8-9,12-13H2,1H3/b7-4+/t14-,21-,22+,24-,25-,26+,27+,28+,29-,30+,31-,32+,33-,34+,35+/m0/s1 |
InChIKey | LKZNLGSMAMRYPE-YQXDOFBWSA-N |
Mol Weight | 786.7 g/mol |
Molecular Formula | C35H46O20 |
Exact Mass | 786.258244 g/mol |
SpectraBase Spectrum ID | C4RY1cNjpXl |
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Name | VERPECTOSIDE-B;CRASSOSIDE |
Compound Number | 3 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C35H46O20 |
InChI | InChI=1S/C35H46O20/c1-14-24(43)26(45)28(47)33(50-14)54-31-30(53-23(42)7-4-15-2-5-17(38)19(40)10-15)22(13-37)52-35(49-9-8-16-3-6-18(39)20(41)11-16)32(31)55-34-29(48)27(46)25(44)21(12-36)51-34/h2-7,10-11,14,21-22,24-41,43-48H,8-9,12-13H2,1H3/b7-4+/t14-,21-,22+,24-,25-,26+,27+,28+,29-,30+,31-,32+,33-,34+,35+/m0/s1 |
InChIKey | LKZNLGSMAMRYPE-YQXDOFBWSA-N |
Literature Reference Author | W.M.ABDEL-MGEED,E.Y.BACKHEET,A.A.KHALIFA,Z.Z.IBRAHEIM,S.A.RO SS |
Literature Reference Citation | FITOTERAPIA,83,500(2012) |
Literature Reference DOI | 10.1016/j.fitote.2011.12.025 |
Molecular Weight | 786.738 g/mol |
Sample ID | 71821 |
Solvent | DMSO-D6 |