| SpectraBase Compound ID | HYqMIwMjtLF |
|---|---|
| InChI | InChI=1S/C47H76O16/c1-22-30(49)33(52)35(54)38(59-22)63-37-32(51)26(61-39-36(55)34(53)31(50)25(20-48)60-39)21-58-40(37)62-29-12-13-44(6)27(43(29,4)5)11-14-46(8)28(44)10-9-23-24-19-42(2,3)15-17-47(24,41(56)57)18-16-45(23,46)7/h9,22,24-40,48-55H,10-21H2,1-8H3,(H,56,57)/t22-,24-,25+,26-,27-,28+,29-,30-,31+,32-,33+,34-,35+,36+,37+,38-,39-,40-,44-,45+,46+,47-/m0/s1 |
| InChIKey | FYSAXYBPXKLMJO-IFECXJOTSA-N |
| Mol Weight | 897.1 g/mol |
| Molecular Formula | C47H76O16 |
| Exact Mass | 896.513336 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LbzVO2VVbPD |
|---|---|
| Name | RADDEANOSIDE-R13 |
| Compound Number | 9 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C47H76O16 |
| InChI | InChI=1S/C47H76O16/c1-22-30(49)33(52)35(54)38(59-22)63-37-32(51)26(61-39-36(55)34(53)31(50)25(20-48)60-39)21-58-40(37)62-29-12-13-44(6)27(43(29,4)5)11-14-46(8)28(44)10-9-23-24-19-42(2,3)15-17-47(24,41(56)57)18-16-45(23,46)7/h9,22,24-40,48-55H,10-21H2,1-8H3,(H,56,57)/t22-,24-,25+,26-,27-,28+,29-,30-,31+,32-,33+,34-,35+,36+,37+,38-,39-,40-,44-,45+,46+,47-/m0/s1 |
| InChIKey | FYSAXYBPXKLMJO-IFECXJOTSA-N |
| Literature Reference Author | W.LI,Y.N.SUN,X.T.YAN,S.Y.YANG,S.J.LEE,H.J.BYUN,C.S.MOON,B.S. HAN,Y.H.KIM |
| Literature Reference Citation | MOLECULES,18,5306(2013) |
| Literature Reference DOI | 10.3390/molecules18055306 |
| Molecular Weight | 897.111 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWBT9301 |