| SpectraBase Compound ID | 5aNClkUeVfX |
|---|---|
| InChI | InChI=1S/C71H102O32/c1-31-18-23-71(87-26-31)32(2)54-49(103-71)25-48-46-17-16-44-24-45(19-21-69(44,14)47(46)20-22-70(48,54)15)97-67-63(96-43(13)82)59(93-40(10)79)56(53(98-67)28-84-34(4)73)100-68-64(102-66-62(95-42(12)81)58(92-39(9)78)51(30-86-66)89-36(6)75)60(55(90-37(7)76)52(99-68)27-83-33(3)72)101-65-61(94-41(11)80)57(91-38(8)77)50(29-85-65)88-35(5)74/h31-32,44-68H,16-30H2,1-15H3/t31-,32-,44-,45-,46+,47-,48-,49-,50-,51-,52-,53+,54-,55-,56-,57+,58+,59-,60+,61-,62-,63+,64-,65+,66+,67+,68+,69-,70-,71-/m0/s1 |
| InChIKey | QAJJYFQUYQEJKW-ZBPMKOBZSA-N |
| Mol Weight | 1467.6 g/mol |
| Molecular Formula | C71H102O32 |
| Exact Mass | 1466.635421 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | BnTBN86ciGh |
|---|---|
| Name | PERACETYL-SAPONIN-1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C71H102O32 |
| InChI | InChI=1S/C71H102O32/c1-31-18-23-71(87-26-31)32(2)54-49(103-71)25-48-46-17-16-44-24-45(19-21-69(44,14)47(46)20-22-70(48,54)15)97-67-63(96-43(13)82)59(93-40(10)79)56(53(98-67)28-84-34(4)73)100-68-64(102-66-62(95-42(12)81)58(92-39(9)78)51(30-86-66)89-36(6)75)60(55(90-37(7)76)52(99-68)27-83-33(3)72)101-65-61(94-41(11)80)57(91-38(8)77)50(29-85-65)88-35(5)74/h31-32,44-68H,16-30H2,1-15H3/t31-,32-,44-,45-,46+,47-,48-,49-,50-,51-,52-,53+,54-,55-,56-,57+,58+,59-,60+,61-,62-,63+,64-,65+,66+,67+,68+,69-,70-,71-/m0/s1 |
| InChIKey | QAJJYFQUYQEJKW-ZBPMKOBZSA-N |
| Literature Reference Author | H.ACHENBACH,H.HUEBNER,W.BRANDT,M.REITER |
| Literature Reference Citation | PHYTOCHEM.,35,1527(1994) |
| Literature Reference DOI | 10.1016/S0031-9422(00)86890-9 |
| Molecular Weight | 1467.572 g/mol |
| Solvent | C6D6 |
| Source File Reference | UWLU25301 |