| SpectraBase Compound ID | EEeUoI18KH4 |
|---|---|
| InChI | InChI=1S/C52H84O24/c1-47(2)14-21-20-8-9-26-49(5)12-11-28(48(3,4)25(49)10-13-50(26,6)51(20,7)40(65)41(66)52(21,19-54)27(57)15-47)72-46-39(76-44-34(63)32(61)31(60)24(16-53)71-44)36(35(64)37(74-46)42(67)68)73-45-38(30(59)23(56)18-70-45)75-43-33(62)29(58)22(55)17-69-43/h8,21-41,43-46,53-66H,9-19H2,1-7H3,(H,67,68)/t21-,22-,23+,24+,25-,26+,27-,28-,29+,30+,31-,32-,33-,34+,35+,36+,37+,38-,39-,40-,41+,43+,44-,45+,46-,49-,50+,51-,52+/m0/s1 |
| InChIKey | SPEUYDGMBXSBEX-AGMDWJHLSA-N |
| Mol Weight | 1093.2 g/mol |
| Molecular Formula | C52H84O24 |
| Exact Mass | 1092.535254 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7QSAg8SXTRN |
|---|---|
| Name | DESACYL-CHAKASAPONIN-IV |
| Compound Number | 1A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C52H84O24 |
| InChI | InChI=1S/C52H84O24/c1-47(2)14-21-20-8-9-26-49(5)12-11-28(48(3,4)25(49)10-13-50(26,6)51(20,7)40(65)41(66)52(21,19-54)27(57)15-47)72-46-39(76-44-34(63)32(61)31(60)24(16-53)71-44)36(35(64)37(74-46)42(67)68)73-45-38(30(59)23(56)18-70-45)75-43-33(62)29(58)22(55)17-69-43/h8,21-41,43-46,53-66H,9-19H2,1-7H3,(H,67,68)/t21-,22-,23+,24+,25-,26+,27-,28-,29+,30+,31-,32-,33-,34+,35+,36+,37+,38-,39-,40-,41+,43+,44-,45+,46-,49-,50+,51-,52+/m0/s1 |
| InChIKey | SPEUYDGMBXSBEX-AGMDWJHLSA-N |
| Literature Reference Author | H.MATSUDA,M.HAMAO,S.NAKAMURA,H.KONI,M.MURATA,M.YOSHIKAWA |
| Literature Reference Citation | CHEM.PHARM.BULL.,60,674(2012) |
| Literature Reference DOI | 10.1248/cpb.60.674 |
| Molecular Weight | 1093.225 g/mol |
| Source File Reference | UWBT4407 |