| SpectraBase Compound ID | 4sVLSLIXgaU |
|---|---|
| InChI | InChI=1S/C54H92O23/c1-49(2,69-9)14-10-15-54(8,77-47-43(68)39(64)37(62)29(74-47)23-71-45-41(66)34(59)26(58)22-70-45)24-11-17-53(7)33(24)25(57)19-31-51(5)16-13-32(50(3,4)30(51)12-18-52(31,53)6)75-48-44(40(65)36(61)28(21-56)73-48)76-46-42(67)38(63)35(60)27(20-55)72-46/h10,14,24-48,55-68H,11-13,15-23H2,1-9H3/b14-10+/t24-,25+,26-,27+,28+,29+,30-,31+,32-,33-,34-,35+,36+,37+,38-,39-,40-,41+,42+,43+,44+,45-,46-,47-,48-,51-,52+,53+,54-/m0/s1 |
| InChIKey | CCBRDBOHWANETE-YWBWMFLCSA-N |
| Mol Weight | 1109.3 g/mol |
| Molecular Formula | C54H92O23 |
| Exact Mass | 1108.602939 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DRiHSJ8cHEr |
|---|---|
| Name | QUINQUEFOLOSIDE-LA |
| Compound Number | 10 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C54H92O23 |
| InChI | InChI=1S/C54H92O23/c1-49(2,69-9)14-10-15-54(8,77-47-43(68)39(64)37(62)29(74-47)23-71-45-41(66)34(59)26(58)22-70-45)24-11-17-53(7)33(24)25(57)19-31-51(5)16-13-32(50(3,4)30(51)12-18-52(31,53)6)75-48-44(40(65)36(61)28(21-56)73-48)76-46-42(67)38(63)35(60)27(20-55)72-46/h10,14,24-48,55-68H,11-13,15-23H2,1-9H3/b14-10+/t24-,25+,26-,27+,28+,29+,30-,31+,32-,33-,34-,35+,36+,37+,38-,39-,40-,41+,42+,43+,44+,45-,46-,47-,48-,51-,52+,53+,54-/m0/s1 |
| InChIKey | CCBRDBOHWANETE-YWBWMFLCSA-N |
| Literature Reference Author | Y.K.QIU,D.Q.DOU,L.P.CAI,H.P.JIANG,T.G.KANG,B.Y.YANG,H.X.KUAN G,M.Z.C.LI |
| Literature Reference Citation | FITOTERAPIA,80,219(2009) |
| Literature Reference DOI | 10.1016/j.fitote.2009.01.011 |
| Molecular Weight | 1109.311 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWIR18003 |