| SpectraBase Compound ID | 67WNdxtpcFW |
|---|---|
| InChI | InChI=1S/C31H42O15/c1-40-20-10-16(5-6-19(20)34)26-18(11-32)17-8-15(9-21(41-2)27(17)46-26)4-3-7-42-29-25(37)24(36)23(35)22(45-29)12-43-30-28(38)31(39,13-33)14-44-30/h5-6,8-10,18,22-26,28-30,32-39H,3-4,7,11-14H2,1-2H3/t18-,22+,23+,24-,25+,26+,28-,29+,30+,31+/m1/s1 |
| InChIKey | FUKLHVYRBRRIBA-JQNNZCACSA-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 | AoVFCRO4cGW |
|---|---|
| Name | CINNACASSOSIDE-B;DIHYDRODEHYDRODICONIFERYL-ALCOHOL-9-BETA-D-APIOFURANOSYL-(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 | C31H42O15 |
| InChI | InChI=1S/C31H42O15/c1-40-20-10-16(5-6-19(20)34)26-18(11-32)17-8-15(9-21(41-2)27(17)46-26)4-3-7-42-29-25(37)24(36)23(35)22(45-29)12-43-30-28(38)31(39,13-33)14-44-30/h5-6,8-10,18,22-26,28-30,32-39H,3-4,7,11-14H2,1-2H3/t18-,22+,23+,24-,25+,26+,28-,29+,30+,31+/m1/s1 |
| InChIKey | FUKLHVYRBRRIBA-JQNNZCACSA-N |
| Literature Reference Author | Q.LUO,S.M.WANG,Q.LU,J.LUO,Y.X.CHENG |
| Literature Reference Citation | MOLECULES,18,10930(2013) |
| Literature Reference DOI | 10.3390/molecules180910930 |
| Molecular Weight | 654.665 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWIR9363 |