| SpectraBase Compound ID | CP49alTYcNK |
|---|---|
| InChI | InChI=1S/C29H36O11/c1-13-18-8-5-16(23(18)27-19(10-20(13)31)14(2)28(36)40-27)11-38-29-26(35)25(34)24(33)21(39-29)12-37-22(32)9-15-3-6-17(30)7-4-15/h3-7,14,19-21,23-27,29-31,33-35H,8-12H2,1-2H3/t14-,19-,20+,21-,23-,24-,25+,26-,27-,29-/m0/s1 |
| InChIKey | RXSKLDPLNDXENS-AEYILFJRSA-N |
| Mol Weight | 560.6 g/mol |
| Molecular Formula | C29H36O11 |
| Exact Mass | 560.225762 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BPz22Wa8u0U |
|---|---|
| Name | LANCEOCREPIDIASIDE-B |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H36O11 |
| InChI | InChI=1S/C29H36O11/c1-13-18-8-5-16(23(18)27-19(10-20(13)31)14(2)28(36)40-27)11-38-29-26(35)25(34)24(33)21(39-29)12-37-22(32)9-15-3-6-17(30)7-4-15/h3-7,14,19-21,23-27,29-31,33-35H,8-12H2,1-2H3/t14-,19-,20+,21-,23-,24-,25+,26-,27-,29-/m0/s1 |
| InChIKey | RXSKLDPLNDXENS-AEYILFJRSA-N |
| Literature Reference Author | Y.TAKEDA,T.MASUDA,H.MORIKAWA,H.AYABE,E.HIRATA,T.SHINZATO,M.A RAMOTO,H.OTSUKA |
| Literature Reference Citation | PHYTOCHEM.,66,727(2005) |
| Literature Reference DOI | 10.1016/j.phytochem.2005.01.004 |
| Molecular Weight | 560.598 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWSI25396 |