| SpectraBase Compound ID | 2h3xlV1jBr |
|---|---|
| InChI | InChI=1S/C35H46O19/c1-16-25(41)26(42)27(43)33(51-16)54-30-28(44)32(48-10-9-18-4-7-20(38)22(12-18)47-2)52-23(13-49-34-31(45)35(46,14-36)15-50-34)29(30)53-24(40)8-5-17-3-6-19(37)21(39)11-17/h3-8,11-12,16,23,25-34,36-39,41-46H,9-10,13-15H2,1-2H3/b8-5+/t16-,23-,25-,26+,27+,28-,29-,30-,31-,32-,33-,34+,35+/m0/s1 |
| InChIKey | RXDDCGCFNNKGCJ-BLBAQHOOSA-N |
| Mol Weight | 770.7 g/mol |
| Molecular Formula | C35H46O19 |
| Exact Mass | 770.263329 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5XCSeOxs73H |
|---|---|
| Name | 6'-BETAD-APIOFURANOSYL-CISTANOSIDE-C |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C35H46O19 |
| InChI | InChI=1S/C35H46O19/c1-16-25(41)26(42)27(43)33(51-16)54-30-28(44)32(48-10-9-18-4-7-20(38)22(12-18)47-2)52-23(13-49-34-31(45)35(46,14-36)15-50-34)29(30)53-24(40)8-5-17-3-6-19(37)21(39)11-17/h3-8,11-12,16,23,25-34,36-39,41-46H,9-10,13-15H2,1-2H3/b8-5+/t16-,23-,25-,26+,27+,28-,29-,30-,31-,32-,33-,34+,35+/m0/s1 |
| InChIKey | RXDDCGCFNNKGCJ-BLBAQHOOSA-N |
| Literature Reference Author | J.H.YI,G.L.ZHANG,B.G.LI,Y.Z.CHEN |
| Literature Reference Citation | PHYTOCHEM.,51,825(1999) |
| Literature Reference DOI | 10.1016/S0031-9422(99)00027-8 |
| Molecular Weight | 770.739 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWUC13 |