![7-BETA-[(E)-4'-O-(BETA-D-GLUCOPYRANOSYL)-CAFFEOYLOXY]-SWEROSIDE](/api/spectrum/ZNptSi76dL/structure.png?h=300&w=458 "7-BETA-[(E)-4'-O-(BETA-D-GLUCOPYRANOSYL)-CAFFEOYLOXY]-SWEROSIDE")
| SpectraBase Compound ID | 2AvsVz9d3Jx |
|---|---|
| InChI | InChI=1S/C31H38O18/c1-2-13-14-8-21(48-28(42)15(14)11-43-29(13)49-31-27(41)25(39)23(37)19(10-33)46-31)47-20(35)6-4-12-3-5-17(16(34)7-12)44-30-26(40)24(38)22(36)18(9-32)45-30/h2-7,11,13-14,18-19,21-27,29-34,36-41H,1,8-10H2/b6-4+/t13-,14+,18+,19+,21+,22+,23+,24-,25-,26+,27+,29+,30+,31-/m1/s1 |
| InChIKey | QVDOOORJGRQTIB-IOHXSNKASA-N |
| Mol Weight | 698.6 g/mol |
| Molecular Formula | C31H38O18 |
| Exact Mass | 698.205814 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ZNptSi76dL |
|---|---|
| Name | 7-BETA-[(E)-4'-O-(BETA-D-GLUCOPYRANOSYL)-CAFFEOYLOXY]-SWEROSIDE |
| Compound Number | 63 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H38O18 |
| InChI | InChI=1S/C31H38O18/c1-2-13-14-8-21(48-28(42)15(14)11-43-29(13)49-31-27(41)25(39)23(37)19(10-33)46-31)47-20(35)6-4-12-3-5-17(16(34)7-12)44-30-26(40)24(38)22(36)18(9-32)45-30/h2-7,11,13-14,18-19,21-27,29-34,36-41H,1,8-10H2/b6-4+/t13-,14+,18+,19+,21+,22+,23+,24-,25-,26+,27+,29+,30+,31-/m1/s1 |
| InChIKey | QVDOOORJGRQTIB-IOHXSNKASA-N |
| Literature Reference Author | B.DINDA,S.DEBNATH,Y.HARIGAYA |
| Literature Reference Citation | CHEM.PHARM.BULL.,55,689(2007) |
| Literature Reference DOI | 10.1248/cpb.55.689 |
| Molecular Weight | 698.632 g/mol |
| Sample ID | 37475 |
| Solvent | CD3OD |