| SpectraBase Compound ID | 5CekSWIq7Sx |
|---|---|
| InChI | InChI=1S/C35H48O14/c1-16(2)26(38)33(44)46-22(13-18-5-8-20(37)9-6-18)32(43)48-24-10-7-19(15-45-34-29(41)28(40)27(39)23(14-36)47-34)25-30-21(11-12-35(24,25)4)17(3)31(42)49-30/h5-6,8-9,16,19,21-30,34,36-41H,3,7,10-15H2,1-2,4H3/t19-,21-,22?,23-,24+,25+,26?,27-,28+,29-,30-,34-,35-/m0/s1 |
| InChIKey | ABYDABCUCPIFTB-RQZPHYRASA-N |
| Mol Weight | 692.8 g/mol |
| Molecular Formula | C35H48O14 |
| Exact Mass | 692.304406 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KrAM7e40NVw |
|---|---|
| Name | IXERISOSIDE-H |
| Compound Number | 19 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C35H48O14 |
| InChI | InChI=1S/C35H48O14/c1-16(2)26(38)33(44)46-22(13-18-5-8-20(37)9-6-18)32(43)48-24-10-7-19(15-45-34-29(41)28(40)27(39)23(14-36)47-34)25-30-21(11-12-35(24,25)4)17(3)31(42)49-30/h5-6,8-9,16,19,21-30,34,36-41H,3,7,10-15H2,1-2,4H3/t19-,21-,22?,23-,24+,25+,26?,27-,28+,29-,30-,34-,35-/m0/s1 |
| InChIKey | ABYDABCUCPIFTB-RQZPHYRASA-N |
| Literature Reference Author | T.WARASHINA,M.ISHINO,T.MIYASE,A.UENO |
| Literature Reference Citation | PHYTOCHEM.,29,3217(1990) |
| Literature Reference DOI | 10.1016/0031-9422(90)80188-M |
| Molecular Weight | 692.758 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWKP6855 |