| SpectraBase Compound ID | 52uy4qnIuFk |
|---|---|
| InChI | InChI=1S/C31H42O15/c1-41-21-6-14(3-4-19(21)35)24-17-8-20(36)22(42-2)7-15(17)5-16(9-32)18(24)11-43-29-27(26(38)25(37)23(10-33)45-29)46-30-28(39)31(40,12-34)13-44-30/h3-4,6-8,16,18,23-30,32-40H,5,9-13H2,1-2H3/t16-,18-,23-,24-,25-,26+,27-,28+,29-,30+,31-/m1/s1 |
| InChIKey | YBUMLRJVGYOZOE-PRRIITRNSA-N |
| Mol Weight | 654.7 g/mol |
| Molecular Formula | C31H42O15 |
| Exact Mass | 654.252371 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9DBbTqVx5zR |
|---|---|
| Name | (-)-ISOLARICIRESINOL-3-ALPHA-O-BETA-APIOFURANOSYL-(1->2)-O-BETA-GLUCOPYRANOSIDE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H42O15 |
| InChI | InChI=1S/C31H42O15/c1-41-21-6-14(3-4-19(21)35)24-17-8-20(36)22(42-2)7-15(17)5-16(9-32)18(24)11-43-29-27(26(38)25(37)23(10-33)45-29)46-30-28(39)31(40,12-34)13-44-30/h3-4,6-8,16,18,23-30,32-40H,5,9-13H2,1-2H3/t16-,18-,23-,24-,25-,26+,27-,28+,29-,30+,31-/m1/s1 |
| InChIKey | YBUMLRJVGYOZOE-PRRIITRNSA-N |
| Literature Reference Author | T.KANCHANAPOOM,P.CHUMSRI,R.KASAI,H.OTSUKA,K.YAMASAKI |
| Literature Reference Citation | PHYTOCHEM.,63,985(2003) |
| Literature Reference DOI | 10.1016/S0031-9422(03)00219-X |
| Molecular Weight | 654.665 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWMS28466 |