| SpectraBase Compound ID | 4OkQAc66jiW |
|---|---|
| InChI | InChI=1S/C41H62O14/c1-19-9-14-41(36(51)55-34-30(47)27(44)26(43)22(18-42)52-34)16-15-39(5)20(21(41)17-19)7-8-24-38(4)12-11-25(37(2,3)23(38)10-13-40(24,39)6)53-35-31(48)28(45)29(46)32(54-35)33(49)50/h7,21-32,34-35,42-48H,1,8-18H2,2-6H3,(H,49,50)/t21-,22?,23?,24?,25-,26?,27?,28?,29?,30?,31?,32?,34?,35?,38-,39+,40+,41-/m0/s1 |
| InChIKey | HNJXWEFPOBKGBH-FGWPLVAISA-N |
| Mol Weight | 778.9 g/mol |
| Molecular Formula | C41H62O14 |
| Exact Mass | 778.413957 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5jne6Ax7JcL |
|---|---|
| Name | BOUSSINGOSIDE-A-2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C41H62O14 |
| InChI | InChI=1S/C41H62O14/c1-19-9-14-41(36(51)55-34-30(47)27(44)26(43)22(18-42)52-34)16-15-39(5)20(21(41)17-19)7-8-24-38(4)12-11-25(37(2,3)23(38)10-13-40(24,39)6)53-35-31(48)28(45)29(46)32(54-35)33(49)50/h7,21-32,34-35,42-48H,1,8-18H2,2-6H3,(H,49,50)/t21-,22?,23?,24?,25-,26?,27?,28?,29?,30?,31?,32?,34?,35?,38-,39+,40+,41-/m0/s1 |
| InChIKey | HNJXWEFPOBKGBH-FGWPLVAISA-N |
| Literature Reference Author | A.ESPADA,J.RODRIGUEZ,M.C.VILLAVERDE,R.RIGUERA |
| Literature Reference Citation | CAN.J.CHEM.,68,2039(1990) |
| Literature Reference DOI | 10.1139/v90-312 |
| Molecular Weight | 778.935 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWED11743 |