SpectraBase Compound ID | EQ99pVL1eTC |
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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 |
SpectraBase Spectrum ID | FNROtXPGXCn |
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Name | CAERULEOSIDE_A |
Compound Number | 5 |
Copyright | Copyright © 2016-2025 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 |