![6''-[(4-HYDROXY)-E-CINNAMOYL]-AMYGDALIN](/api/spectrum/JnAeqKbcLm4/structure.png?h=300&w=458 "6''-[(4-HYDROXY)-E-CINNAMOYL]-AMYGDALIN")
| SpectraBase Compound ID | FABBomcMSHC |
|---|---|
| InChI | InChI=1S/C29H33NO13/c30-12-18(16-4-2-1-3-5-16)41-29-27(38)25(36)23(34)20(43-29)14-40-28-26(37)24(35)22(33)19(42-28)13-39-21(32)11-8-15-6-9-17(31)10-7-15/h1-11,18-20,22-29,31,33-38H,13-14H2/b11-8+/t18-,19+,20-,22+,23-,24-,25+,26+,27-,28+,29-/m0/s1 |
| InChIKey | ANZAOUHGPQAOBB-UOSJEUDTSA-N |
| Mol Weight | 603.6 g/mol |
| Molecular Formula | C29H33NO13 |
| Exact Mass | 603.19519 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JnAeqKbcLm4 |
|---|---|
| Name | 6''-[(4-HYDROXY)-E-CINNAMOYL]-AMYGDALIN |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H33NO13 |
| InChI | InChI=1S/C29H33NO13/c30-12-18(16-4-2-1-3-5-16)41-29-27(38)25(36)23(34)20(43-29)14-40-28-26(37)24(35)22(33)19(42-28)13-39-21(32)11-8-15-6-9-17(31)10-7-15/h1-11,18-20,22-29,31,33-38H,13-14H2/b11-8+/t18-,19+,20-,22+,23-,24-,25+,26+,27-,28+,29-/m0/s1 |
| InChIKey | ANZAOUHGPQAOBB-UOSJEUDTSA-N |
| Literature Reference Author | A.NAHRSTEDT,E.A.SATTAR,S.M.H.EL-ZALABANI |
| Literature Reference Citation | PHYTOCHEM.,29,1179(1990) |
| Literature Reference DOI | 10.1016/0031-9422(90)85424-E |
| Molecular Weight | 603.580 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWVN29546 |