| SpectraBase Compound ID | LeNhXQxvTLY |
|---|---|
| InChI | InChI=1S/C27H36O11/c1-14-8-16(28)11-27(2,3)17(14)12-37-26-25(33)24(32)23(31)20(38-26)13-36-21(29)7-6-15-9-18(34-4)22(30)19(10-15)35-5/h6-10,17,20,23-26,30-33H,11-13H2,1-5H3/b7-6+/t17-,20+,23+,24-,25+,26+/m1/s1 |
| InChIKey | SGHMUAWQXUYUAJ-MKSCJPHYSA-N |
| Mol Weight | 536.6 g/mol |
| Molecular Formula | C27H36O11 |
| Exact Mass | 536.225762 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5avFI6FehSQ |
|---|---|
| Name | 6'-O-SINAPOYLJASMINOSIDE_A |
| Compound Number | 7 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H36O11 |
| InChI | InChI=1S/C27H36O11/c1-14-8-16(28)11-27(2,3)17(14)12-37-26-25(33)24(32)23(31)20(38-26)13-36-21(29)7-6-15-9-18(34-4)22(30)19(10-15)35-5/h6-10,17,20,23-26,30-33H,11-13H2,1-5H3/b7-6+/t17-,20+,23+,24-,25+,26+/m1/s1 |
| InChIKey | SGHMUAWQXUYUAJ-MKSCJPHYSA-N |
| Literature Reference Author | Q.C.CHEN,U.YOUN,B.S.MIN,K.H.BAE |
| Literature Reference Citation | J.NAT.PROD.,71,995(2008) |
| Literature Reference DOI | 10.1021/np800002z |
| Molecular Weight | 536.576 g/mol |
| Sample ID | 28051 |
| Solvent | CD3OD |