| SpectraBase Compound ID | 5fyaNUm5yqV |
|---|---|
| InChI | InChI=1S/C50H50O20/c1-17-9-27-35(29-13-25(15-33(57)39(29)42(60)37(27)31(55)11-17)69-49-47(67-23(7)53)44(62)45(20(4)64-49)65-21(5)51)36-28-10-18(2)12-32(56)38(28)43(61)40-30(36)14-26(16-34(40)58)70-50-48(68-24(8)54)46(66-22(6)52)41(59)19(3)63-50/h9-16,19-20,35-36,41,44-50,55-59,62H,1-8H3/t19-,20-,35?,36?,41-,44+,45-,46+,47-,48-,49-,50-/m0/s1 |
| InChIKey | JEXQJQKTBMMMPJ-HSUZKLQJSA-N |
| Mol Weight | 970.9 g/mol |
| Molecular Formula | C50H50O20 |
| Exact Mass | 970.289544 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CDwJ32gxUQc |
|---|---|
| Name | RHAMNEPALIN |
| Compound Number | 11A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C50H50O20 |
| InChI | InChI=1S/C50H50O20/c1-17-9-27-35(29-13-25(15-33(57)39(29)42(60)37(27)31(55)11-17)69-49-47(67-23(7)53)44(62)45(20(4)64-49)65-21(5)51)36-28-10-18(2)12-32(56)38(28)43(61)40-30(36)14-26(16-34(40)58)70-50-48(68-24(8)54)46(66-22(6)52)41(59)19(3)63-50/h9-16,19-20,35-36,41,44-50,55-59,62H,1-8H3/t19-,20-,35?,36?,41-,44+,45-,46+,47-,48-,49-,50-/m0/s1 |
| InChIKey | JEXQJQKTBMMMPJ-HSUZKLQJSA-N |
| Literature Reference Author | L.P.MAI,F.GUERITTE,V.DUMONTET,M.V.TRI,B.HILL,O.THOISON,D.GUE NARD,T.SEVENET |
| Literature Reference Citation | J.NAT.PROD.,64,1162(2001) |
| Literature Reference DOI | 10.1021/np010030v |
| Molecular Weight | 970.935 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWSI1895 |