SpectraBase Compound ID | 41PFdsyTbUp |
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InChI | InChI=1S/C33H38O21/c34-8-15-19(37)22(40)25(43)31(51-15)48-9-16-20(38)28(53-32-26(44)23(41)24(42)29(54-32)30(46)47)27(45)33(52-16)50-14-7-13-17(21(39)18(14)36)11(35)6-12(49-13)10-4-2-1-3-5-10/h1-7,15-16,19-20,22-29,31-34,36-45H,8-9H2,(H,46,47)/t15-,16-,19-,20-,22+,23+,24+,25-,26-,27-,28+,29+,31-,32-,33-/m1/s1 |
InChIKey | WGKCAJVEAWJNOY-YKRYGYPDSA-N |
Mol Weight | 770.6 g/mol |
Molecular Formula | C33H38O21 |
Exact Mass | 770.190558 g/mol |
SpectraBase Spectrum ID | 24UC1R85qtd |
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Name | BAICALEIN-7-O-BETA-D-GLUCURONOPYRANOSYL-(1->3)[BETA-D-GLUCOPYRANOSYL-(1->6]-BETA-D-GLUCOPYRANOSIDE |
Compound Number | 2 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C33H38O21 |
InChI | InChI=1S/C33H38O21/c34-8-15-19(37)22(40)25(43)31(51-15)48-9-16-20(38)28(53-32-26(44)23(41)24(42)29(54-32)30(46)47)27(45)33(52-16)50-14-7-13-17(21(39)18(14)36)11(35)6-12(49-13)10-4-2-1-3-5-10/h1-7,15-16,19-20,22-29,31-34,36-45H,8-9H2,(H,46,47)/t15-,16-,19-,20-,22+,23+,24+,25-,26-,27-,28+,29+,31-,32-,33-/m1/s1 |
InChIKey | WGKCAJVEAWJNOY-YKRYGYPDSA-N |
Literature Reference Author | R.Y.YAN,Y.Y.CAO,C.Y.CHEN,H.Q.DAI,S.X.YU,J.L.WEI,H.LI,B.YANG |
Literature Reference Citation | FITOTERAPIA,82,841(2011) |
Literature Reference DOI | 10.1016/j.fitote.2011.04.006 |
Molecular Weight | 770.652 g/mol |
Solvent | DMSO-D6 |
Source File Reference | UWDB1074 |