| SpectraBase Compound ID | 7QxlrVxHagC |
|---|---|
| InChI | InChI=1S/C34H50O13/c1-16-27(45-28-26(38)25(37)24(36)20(15-35)44-28)19(41-4)14-23(42-16)43-18-6-9-30(2)17(13-18)5-11-33(40)21(30)7-10-32-22-8-12-34(32,33)47-31(22,3)46-29(32)39/h5,16,18-28,35-38,40H,6-15H2,1-4H3/t16-,18+,19-,20+,21-,22-,23+,24+,25-,26+,27+,28-,30+,31-,32-,33-,34+/m1/s1 |
| InChIKey | KQAOLMVLVDVNTP-MARWAQGASA-N |
| Mol Weight | 666.8 g/mol |
| Molecular Formula | C34H50O13 |
| Exact Mass | 666.325142 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JjVVJNT0bl5 |
|---|---|
| Name | AMALOSIDE-B;AMALOGENIN-A-3-O-BETA-D-GLUCOPYRANOSYL-(1->4)-BETA-D-DIGINOPYRANOSIDE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H50O13 |
| InChI | InChI=1S/C34H50O13/c1-16-27(45-28-26(38)25(37)24(36)20(15-35)44-28)19(41-4)14-23(42-16)43-18-6-9-30(2)17(13-18)5-11-33(40)21(30)7-10-32-22-8-12-34(32,33)47-31(22,3)46-29(32)39/h5,16,18-28,35-38,40H,6-15H2,1-4H3/t16-,18+,19-,20+,21-,22-,23+,24+,25-,26+,27+,28-,30+,31-,32-,33-,34+/m1/s1 |
| InChIKey | KQAOLMVLVDVNTP-MARWAQGASA-N |
| Literature Reference Author | H.YING-JIE,S.XIAO-LING,M.QAN-ZHANG,L.YANG,Z.QI-TAI |
| Literature Reference Citation | PHYTOCHEM.,31,2099(1992) |
| Literature Reference DOI | 10.1016/0031-9422(92)80370-T |
| Molecular Weight | 666.763 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWVN6139 |