SpectraBase Compound ID | EWVtTUbnxKD |
---|---|
InChI | InChI=1S/C51H62O27/c1-65-28-15-24(7-11-27(28)55)8-13-37(57)74-46-34(21-53)77-51(23-54,48(46)75-38(58)14-10-26-18-31(68-4)45(70-6)32(19-26)69-5)78-50-47(76-49-44(64)42(62)40(60)33(20-52)72-49)43(63)41(61)35(73-50)22-71-36(56)12-9-25-16-29(66-2)39(59)30(17-25)67-3/h7-19,33-35,40-44,46-50,52-55,59-64H,20-23H2,1-6H3/b12-9+,13-8+,14-10+/t33-,34+,35-,40-,41-,42+,43+,44-,46+,47-,48-,49+,50-,51-/m1/s1 |
InChIKey | DAXQZVPKDIVXBX-XUPPZSRNSA-N |
Mol Weight | 1107.0 g/mol |
Molecular Formula | C51H62O27 |
Exact Mass | 1106.347847 g/mol |
SpectraBase Spectrum ID | vlA5j8y0OR |
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Name | TRICORNOSE_F;#14;3-O-(E)-3,4,5-TRIMETHOXYCINNAMOYL-[4-O-(E)-FERULOYL]-BETA-D-FRUCTOFURANOSYL-(2->1)-[BETA-D-GLUCOPYRANOSYL-(1->2)]-[6-O-(E)-SINAPOYL]-ALPHA-D-G |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C51H62O27 |
InChI | InChI=1S/C51H62O27/c1-65-28-15-24(7-11-27(28)55)8-13-37(57)74-46-34(21-53)77-51(23-54,48(46)75-38(58)14-10-26-18-31(68-4)45(70-6)32(19-26)69-5)78-50-47(76-49-44(64)42(62)40(60)33(20-52)72-49)43(63)41(61)35(73-50)22-71-36(56)12-9-25-16-29(66-2)39(59)30(17-25)67-3/h7-19,33-35,40-44,46-50,52-55,59-64H,20-23H2,1-6H3/b12-9+,13-8+,14-10+/t33-,34+,35-,40-,41-,42+,43+,44-,46+,47-,48-,49+,50-,51-/m1/s1 |
InChIKey | DAXQZVPKDIVXBX-XUPPZSRNSA-N |
Literature Reference Author | J.LI,Y.JIANG,P.F.TU |
Literature Reference Citation | J.NAT.PROD.,68,739(2005) |
Literature Reference DOI | 10.1021/np050023x |
Molecular Weight | 1107.037 g/mol |
Solvent | CD3OD |