| SpectraBase Compound ID | EQ99pVL1eTC |
|---|---|
| InChI | InChI=1S/C34H48O19/c1-5-13-14(16(29(42)44-3)9-47-31(13)52-33-26(40)24(38)23(37)19(8-35)49-33)7-21-46-11-20-28(51-21)25(39)27(41)34(50-20)53-32-22-12(2)18(36)6-15(22)17(10-48-32)30(43)45-4/h5,9-10,12-15,18-28,31-41H,1,6-8,11H2,2-4H3/t12-,13-,14+,15+,18-,19+,20-,21-,22+,23+,24-,25-,26+,27-,28-,31+,32-,33-,34+/m1/s1 |
| InChIKey | NQBFKEUBLNKXCW-DDWMFDKSSA-N |
| Mol Weight | 760.7 g/mol |
| Molecular Formula | C34H48O19 |
| Exact Mass | 760.278979 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FNROtXPGXCn |
|---|---|
| Name | CAERULEOSIDE_A |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H48O19 |
| InChI | InChI=1S/C34H48O19/c1-5-13-14(16(29(42)44-3)9-47-31(13)52-33-26(40)24(38)23(37)19(8-35)49-33)7-21-46-11-20-28(51-21)25(39)27(41)34(50-20)53-32-22-12(2)18(36)6-15(22)17(10-48-32)30(43)45-4/h5,9-10,12-15,18-28,31-41H,1,6-8,11H2,2-4H3/t12-,13-,14+,15+,18-,19+,20-,21-,22+,23+,24-,25-,26+,27-,28-,31+,32-,33-,34+/m1/s1 |
| InChIKey | NQBFKEUBLNKXCW-DDWMFDKSSA-N |
| Literature Reference Author | K.MACHIDA,J.ASANO,M.KIKUCHI |
| Literature Reference Citation | PHYTOCHEM.,39,111(1995) |
| Literature Reference DOI | 10.1016/0031-9422(94)00853-L |
| Molecular Weight | 760.744 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWMZ8326 |