| SpectraBase Compound ID | JqjP9cc1RTs |
|---|---|
| InChI | InChI=1S/C41H64O14/c1-36(2)16-20-19-8-9-23-38(5)12-11-25(37(3,4)22(38)10-13-40(23,7)39(19,6)14-15-41(20,35(50)51)24(43)17-36)53-34-29(47)30(28(46)31(55-34)32(48)49)54-33-27(45)26(44)21(42)18-52-33/h8,20-31,33-34,42-47H,9-18H2,1-7H3,(H,48,49)(H,50,51)/t20-,21-,22-,23+,24-,25-,26-,27+,28+,29+,30-,31-,33-,34+,38-,39+,40+,41-/m0/s1 |
| InChIKey | FOCJYVVPFHSVGZ-YPRRBPMTSA-N |
| Mol Weight | 780.9 g/mol |
| Molecular Formula | C41H64O14 |
| Exact Mass | 780.429607 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AcsybQ3dB9i |
|---|---|
| Name | SCOPARIANOSIDE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C41H64O14 |
| InChI | InChI=1S/C41H64O14/c1-36(2)16-20-19-8-9-23-38(5)12-11-25(37(3,4)22(38)10-13-40(23,7)39(19,6)14-15-41(20,35(50)51)24(43)17-36)53-34-29(47)30(28(46)31(55-34)32(48)49)54-33-27(45)26(44)21(42)18-52-33/h8,20-31,33-34,42-47H,9-18H2,1-7H3,(H,48,49)(H,50,51)/t20-,21-,22-,23+,24-,25-,26-,27+,28+,29+,30-,31-,33-,34+,38-,39+,40+,41-/m0/s1 |
| InChIKey | FOCJYVVPFHSVGZ-YPRRBPMTSA-N |
| Literature Reference Author | M.MURGU,L.F.A.SANTOS,G.D.D.SOUZA,C.DAOLIO,B.SCHNEIDER,A.G.FE RREIRA |
| Literature Reference Citation | J.BRAZ.CHEM.SOC.,19,831(2008) |
| Literature Reference DOI | 10.1590/s0103-50532008000500004 |
| Molecular Weight | 780.951 g/mol |
| Source File Reference | UWIR5223 |