| SpectraBase Compound ID | 4xx7Nxih4el |
|---|---|
| InChI | InChI=1S/C49H84O28/c1-19(9-7-11-21(3)16-67-49-43(77-47-39(65)35(61)29(55)23(5)71-47)41(33(59)27(15-51)73-49)75-45-37(63)31(57)25(53)18-69-45)8-6-10-20(2)12-13-66-48-42(76-46-38(64)34(60)28(54)22(4)70-46)40(32(58)26(14-50)72-48)74-44-36(62)30(56)24(52)17-68-44/h8,12,21-65H,6-7,9-11,13-18H2,1-5H3/b19-8+,20-12+/t21-,22+,23-,24+,25-,26+,27-,28+,29-,30-,31+,32+,33-,34-,35+,36+,37-,38-,39+,40-,41+,42+,43-,44?,45?,46?,47?,48?,49?/m0/s1 |
| InChIKey | WCAFCVFPRLBNFI-QZJMEWRVSA-N |
| Mol Weight | 1121.2 g/mol |
| Molecular Formula | C49H84O28 |
| Exact Mass | 1120.514912 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | LGOQBh9iagr |
|---|---|
| Name | PYISHIAUOSIDE-IVA |
| Compound Number | 10 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C49H84O28 |
| InChI | InChI=1S/C49H84O28/c1-19(9-7-11-21(3)16-67-49-43(77-47-39(65)35(61)29(55)23(5)71-47)41(33(59)27(15-51)73-49)75-45-37(63)31(57)25(53)18-69-45)8-6-10-20(2)12-13-66-48-42(76-46-38(64)34(60)28(54)22(4)70-46)40(32(58)26(14-50)72-48)74-44-36(62)30(56)24(52)17-68-44/h8,12,21-65H,6-7,9-11,13-18H2,1-5H3/b19-8+,20-12+/t21-,22+,23-,24+,25-,26+,27-,28+,29-,30-,31+,32+,33-,34-,35+,36+,37-,38-,39+,40-,41+,42+,43-,44?,45?,46?,47?,48?,49?/m0/s1 |
| InChIKey | WCAFCVFPRLBNFI-QZJMEWRVSA-N |
| Literature Reference Author | W.H.WONG,R.KASAI,W.CHOSHI,Y.NAKAGAWA,K.MIZUTANI,K.OHTANI,O.T ANAKA |
| Literature Reference Citation | PHYTOCHEM.,30,2699(1991) |
| Literature Reference DOI | 10.1016/0031-9422(91)85126-K |
| Molecular Weight | 1121.189 g/mol |
| Solvent | CD3OD:D2O-DROPS |
| Source File Reference | UWVN30876 |