| SpectraBase Compound ID | AeqTR5OAVyk |
|---|---|
| InChI | InChI=1S/C27H34O11/c1-32-17-6-4-13(8-19(17)33-2)25-15-11-36-26(16(15)12-35-25)14-5-7-18(20(9-14)34-3)37-27-24(31)23(30)22(29)21(10-28)38-27/h4-9,15-16,21-31H,10-12H2,1-3H3/t15-,16-,21+,22+,23-,24+,25+,26-,27+/m0/s1 |
| InChIKey | KFFCKOBAHMGTMW-GBRPDIMTSA-N |
| Mol Weight | 534.6 g/mol |
| Molecular Formula | C27H34O11 |
| Exact Mass | 534.210112 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | H35Gb0kwNDM |
|---|---|
| Name | PHILLYRIN;PHILLYGENIN-4-O-GLUCOPYRANOSIDE |
| Compound Number | 10 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H34O11 |
| InChI | InChI=1S/C27H34O11/c1-32-17-6-4-13(8-19(17)33-2)25-15-11-36-26(16(15)12-35-25)14-5-7-18(20(9-14)34-3)37-27-24(31)23(30)22(29)21(10-28)38-27/h4-9,15-16,21-31H,10-12H2,1-3H3/t15-,16-,21+,22+,23-,24+,25+,26-,27+/m0/s1 |
| InChIKey | KFFCKOBAHMGTMW-GBRPDIMTSA-N |
| Literature Reference Author | M.M.A.RAHMAN,P.M.DEWICK,D.E.JACKSON,J.A.LUCAS |
| Literature Reference Citation | PHYTOCHEM.,29,1971(1990) |
| Literature Reference DOI | 10.1016/0031-9422(90)85050-P |
| Molecular Weight | 534.560 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWLU32243 |