| SpectraBase Compound ID | 4106HCFizZx |
|---|---|
| InChI | InChI=1S/C27H38O12/c1-10(2)13-6-17(37-27-25(35)23(33)21(31)19(9-29)39-27)12(4)14-7-16(11(3)5-15(13)14)36-26-24(34)22(32)20(30)18(8-28)38-26/h5-7,10,18-35H,8-9H2,1-4H3/t18-,19-,20-,21-,22+,23+,24-,25-,26-,27-/m1/s1 |
| InChIKey | OLIORBRJIHGQPQ-DVCSACCXSA-N |
| Mol Weight | 554.6 g/mol |
| Molecular Formula | C27H38O12 |
| Exact Mass | 554.236327 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4tC1apw14hT |
|---|---|
| Name | ALANGICADINOSIDE-C |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H38O12 |
| InChI | InChI=1S/C27H38O12/c1-10(2)13-6-17(37-27-25(35)23(33)21(31)19(9-29)39-27)12(4)14-7-16(11(3)5-15(13)14)36-26-24(34)22(32)20(30)18(8-28)38-26/h5-7,10,18-35H,8-9H2,1-4H3/t18-,19-,20-,21-,22+,23+,24-,25-,26-,27-/m1/s1 |
| InChIKey | OLIORBRJIHGQPQ-DVCSACCXSA-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 | 554.592 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWLU4379 |