| SpectraBase Compound ID | FguLY9PoAvy |
|---|---|
| InChI | InChI=1S/C48H78O19/c1-43(2)14-15-48(20-51)22(16-43)21-8-9-26-45(5)12-11-28(44(3,4)25(45)10-13-46(26,6)47(21,7)17-27(48)52)64-42-38(67-41-34(58)32(56)30(54)24(19-50)63-41)36(35(59)37(66-42)39(60)61)65-40-33(57)31(55)29(53)23(18-49)62-40/h8,22-38,40-42,49-59H,9-20H2,1-7H3,(H,60,61)/t22?,23-,24+,25?,26?,27-,28+,29+,30+,31+,32-,33-,34+,35+,36+,37+,38-,40+,41-,42-,45+,46-,47-,48-/m1/s1 |
| InChIKey | GKKKVIOYRRXKIS-NCPBRQQNSA-N |
| Mol Weight | 959.1 g/mol |
| Molecular Formula | C48H78O19 |
| Exact Mass | 958.51373 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1MBSc3Xm92n |
|---|---|
| Name | PS-3 |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C48H78O19 |
| InChI | InChI=1S/C48H78O19/c1-43(2)14-15-48(20-51)22(16-43)21-8-9-26-45(5)12-11-28(44(3,4)25(45)10-13-46(26,6)47(21,7)17-27(48)52)64-42-38(67-41-34(58)32(56)30(54)24(19-50)63-41)36(35(59)37(66-42)39(60)61)65-40-33(57)31(55)29(53)23(18-49)62-40/h8,22-38,40-42,49-59H,9-20H2,1-7H3,(H,60,61)/t22?,23-,24+,25?,26?,27-,28+,29+,30+,31+,32-,33-,34+,35+,36+,37+,38-,40+,41-,42-,45+,46-,47-,48-/m1/s1 |
| InChIKey | GKKKVIOYRRXKIS-NCPBRQQNSA-N |
| Literature Reference Author | K.OHTANI,S.MAVI,K.HOSTETTMANN |
| Literature Reference Citation | PHYTOCHEM.,33,83(1993) |
| Literature Reference DOI | 10.1016/0031-9422(93)85400-L |
| Molecular Weight | 959.136 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWVN6206 |