![SCROPOLIOSIDE-D;6-O-[(2'',4''-DI-O-ACETYL-3''-O-TRANS-CINNAMOYL)-ALPHA-L-RHAMNOPYRANOSYL]-CATALPOL](/api/spectrum/3634N2Sc7Ol/structure.png?h=300&w=458 "SCROPOLIOSIDE-D;6-O-[(2'',4''-DI-O-ACETYL-3''-O-TRANS-CINNAMOYL)-ALPHA-L-RHAMNOPYRANOSYL]-CATALPOL")
| SpectraBase Compound ID | 9kV5WJ9iG1X |
|---|---|
| InChI | InChI=1S/C34H42O17/c1-15-26(45-16(2)37)28(48-21(39)10-9-18-7-5-4-6-8-18)29(46-17(3)38)33(44-15)49-27-19-11-12-43-31(22(19)34(14-36)30(27)51-34)50-32-25(42)24(41)23(40)20(13-35)47-32/h4-12,15,19-20,22-33,35-36,40-42H,13-14H2,1-3H3/b10-9+/t15-,19?,20+,22?,23+,24-,25+,26-,27-,28+,29+,30-,31-,32-,33-,34+/m0/s1 |
| InChIKey | XTDOKCBBQODVJW-RLELHGQLSA-N |
| Mol Weight | 722.7 g/mol |
| Molecular Formula | C34H42O17 |
| Exact Mass | 722.2422 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3634N2Sc7Ol |
|---|---|
| Name | SCROPOLIOSIDE-D;6-O-[(2'',4''-DI-O-ACETYL-3''-O-TRANS-CINNAMOYL)-ALPHA-L-RHAMNOPYRANOSYL]-CATALPOL |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H42O17 |
| InChI | InChI=1S/C34H42O17/c1-15-26(45-16(2)37)28(48-21(39)10-9-18-7-5-4-6-8-18)29(46-17(3)38)33(44-15)49-27-19-11-12-43-31(22(19)34(14-36)30(27)51-34)50-32-25(42)24(41)23(40)20(13-35)47-32/h4-12,15,19-20,22-33,35-36,40-42H,13-14H2,1-3H3/b10-9+/t15-,19?,20+,22?,23+,24-,25+,26-,27-,28+,29+,30-,31-,32-,33-,34+/m0/s1 |
| InChIKey | XTDOKCBBQODVJW-RLELHGQLSA-N |
| Literature Reference Author | I.CALIS,M.ZOR,A.A.BASARAN,A.D.WRIGHT,O.STICHER |
| Literature Reference Citation | J.NAT.PROD.,56,606(1993) |
| Literature Reference DOI | 10.1021/np50094a022 |
| Molecular Weight | 722.697 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWCS5616 |