| SpectraBase Compound ID | 4EgS5rad4jG |
|---|---|
| InChI | InChI=1S/C34H48O17/c1-12-7-15(48-29-21(39)20(38)19(37)16(10-35)49-29)26(41)32(5)14(12)9-17-33-11-47-34(30(44)46-6,27(42)22(40)24(32)33)25(33)23(28(43)50-17)51-18(36)8-13(2)31(3,4)45/h7-8,14-17,19-27,29,35,37-42,45H,9-11H2,1-6H3/b13-8+/t14-,15-,16-,17+,19-,20+,21-,22+,23+,24+,25+,26+,27-,29-,32-,33+,34-/m0/s1 |
| InChIKey | IGJZDFGUTCEARG-UVFCWHNDSA-N |
| Mol Weight | 728.7 g/mol |
| Molecular Formula | C34H48O17 |
| Exact Mass | 728.28915 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HXzzL9SDLfJ |
|---|---|
| Name | JAVANICOSIDE-K |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H48O17 |
| InChI | InChI=1S/C34H48O17/c1-12-7-15(48-29-21(39)20(38)19(37)16(10-35)49-29)26(41)32(5)14(12)9-17-33-11-47-34(30(44)46-6,27(42)22(40)24(32)33)25(33)23(28(43)50-17)51-18(36)8-13(2)31(3,4)45/h7-8,14-17,19-27,29,35,37-42,45H,9-11H2,1-6H3/b13-8+/t14-,15-,16-,17+,19-,20+,21-,22+,23+,24+,25+,26+,27-,29-,32-,33+,34-/m0/s1 |
| InChIKey | IGJZDFGUTCEARG-UVFCWHNDSA-N |
| Literature Reference Author | I.H.KIM,Y.HITOTSUYANAGI,K.TAKEYA |
| Literature Reference Citation | PHYTOCHEM.,65,3167(2004) |
| Literature Reference DOI | 10.1016/j.phytochem.2004.08.029 |
| Molecular Weight | 728.745 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWSI25623 |