| SpectraBase Compound ID | Bhe7K6KOjBL |
|---|---|
| InChI | InChI=1S/C49H82O19/c1-22-31(54)39(68-42-37(60)35(58)33(56)27(19-51)65-42)38(61)43(63-22)66-29-10-11-45(4)28(46(29,5)20-52)9-12-47(6)40(45)25(62-8)15-23-24-16-44(2,3)13-14-49(24,21-53)30(17-48(23,47)7)67-41-36(59)34(57)32(55)26(18-50)64-41/h15,22,24-43,50-61H,9-14,16-21H2,1-8H3/t22-,24+,25-,26-,27-,28-,29+,30+,31+,32-,33-,34+,35+,36-,37-,38-,39+,40-,41+,42+,43+,45+,46+,47-,48-,49-/m1/s1 |
| InChIKey | GVLGJDVZELRZJU-BRYUWNISSA-N |
| Mol Weight | 975.2 g/mol |
| Molecular Formula | C49H82O19 |
| Exact Mass | 974.54503 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | E9jRtmilx6m |
|---|---|
| Name | CLINOPOSAPONIN-VII-A |
| Compound Number | 4A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C49H82O19 |
| InChI | InChI=1S/C49H82O19/c1-22-31(54)39(68-42-37(60)35(58)33(56)27(19-51)65-42)38(61)43(63-22)66-29-10-11-45(4)28(46(29,5)20-52)9-12-47(6)40(45)25(62-8)15-23-24-16-44(2,3)13-14-49(24,21-53)30(17-48(23,47)7)67-41-36(59)34(57)32(55)26(18-50)64-41/h15,22,24-43,50-61H,9-14,16-21H2,1-8H3/t22-,24+,25-,26-,27-,28-,29+,30+,31+,32-,33-,34+,35+,36-,37-,38-,39+,40-,41+,42+,43+,45+,46+,47-,48-,49-/m1/s1 |
| InChIKey | GVLGJDVZELRZJU-BRYUWNISSA-N |
| Literature Reference Author | A.YAMAMOTO,H.SUZUKI,T.MIYASE,A.UENO,T.MAEDA |
| Literature Reference Citation | PHYTOCHEM.,34,485(1993) |
| Literature Reference DOI | 10.1016/0031-9422(93)80035-Q |
| Molecular Weight | 975.179 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWLU7349 |