| SpectraBase Compound ID | 53yaBMkJXQ0 |
|---|---|
| InChI | InChI=1S/C27H42O13/c1-9(2)12-6-14(37-26-23(35)21(33)18(30)15(7-28)38-26)11(4)17-13(12)5-10(3)25(20(17)32)40-27-24(36)22(34)19(31)16(8-29)39-27/h5,9,11-12,14-16,18-19,21-24,26-36H,6-8H2,1-4H3/t11?,12?,14?,15-,16+,18-,19+,21+,22-,23-,24+,26-,27-/m1/s1 |
| InChIKey | YRVIELBGQOBLNE-NVPIIUPKSA-N |
| Mol Weight | 574.6 g/mol |
| Molecular Formula | C27H42O13 |
| Exact Mass | 574.262541 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DGd9vbbCfcm |
|---|---|
| Name | ALANGICADINOSIDE-A |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H42O13 |
| InChI | InChI=1S/C27H42O13/c1-9(2)12-6-14(37-26-23(35)21(33)18(30)15(7-28)38-26)11(4)17-13(12)5-10(3)25(20(17)32)40-27-24(36)22(34)19(31)16(8-29)39-27/h5,9,11-12,14-16,18-19,21-24,26-36H,6-8H2,1-4H3/t11?,12?,14?,15-,16+,18-,19+,21+,22-,23-,24+,26-,27-/m1/s1 |
| InChIKey | YRVIELBGQOBLNE-NVPIIUPKSA-N |
| Literature Reference Author | H.OTSUKA,M.YAO,E.HIRATA,A.TAKUSHI,Y.TAKEDA |
| Literature Reference Citation | PHYTOCHEM.,41,1351(1996) |
| Literature Reference DOI | 10.1016/0031-9422(95)00799-7 |
| Molecular Weight | 574.623 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWLU4377 |