![AESCULIOSIDE-F;#6;21-O-TIGLOYL-22-O-ANGELOYLPROTOAESCIGENIN-3-O-[BETA-D-GLUCOPYRANOSYL-(1->2)]-[BETA-D-GLUCOPYRANOSYL-(1->4)]-METHYL-BETA-D-GLUCURONOPYRANOSATE](/api/spectrum/BM9RuB0bWh5/structure.png?h=300&w=458 "AESCULIOSIDE-F;#6;21-O-TIGLOYL-22-O-ANGELOYLPROTOAESCIGENIN-3-O-[BETA-D-GLUCOPYRANOSYL-(1->2)]-[BETA-D-GLUCOPYRANOSYL-(1->4)]-METHYL-BETA-D-GLUCURONOPYRANOSATE")
| SpectraBase Compound ID | Ji8bI9WSVOc |
|---|---|
| InChI | InChI=1S/C59H92O24/c1-12-26(3)48(72)82-46-47(83-49(73)27(4)13-2)59(25-63)29(20-54(46,5)6)28-14-15-33-55(7)18-17-35(56(8,24-62)32(55)16-19-57(33,9)58(28,10)21-34(59)64)78-53-44(80-52-41(70)39(68)37(66)31(23-61)77-52)42(71)43(45(81-53)50(74)75-11)79-51-40(69)38(67)36(65)30(22-60)76-51/h12-14,29-47,51-53,60-71H,15-25H2,1-11H3/b26-12+,27-13-/t29-,30+,31+,32?,33?,34+,35-,36+,37+,38-,39-,40+,41+,42+,43+,44-,45+,46-,47-,51-,52-,53-,55-,56+,57+,58+,59-/m0/s1 |
| InChIKey | LFHVPGKXRMSZAI-BWNISZONSA-N |
| Mol Weight | 1185.4 g/mol |
| Molecular Formula | C59H92O24 |
| Exact Mass | 1184.597854 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 | BM9RuB0bWh5 |
|---|---|
| Name | AESCULIOSIDE-F;#6;21-O-TIGLOYL-22-O-ANGELOYLPROTOAESCIGENIN-3-O-[BETA-D-GLUCOPYRANOSYL-(1->2)]-[BETA-D-GLUCOPYRANOSYL-(1->4)]-METHYL-BETA-D-GLUCURONOPYRANOSATE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C59H92O24 |
| InChI | InChI=1S/C59H92O24/c1-12-26(3)48(72)82-46-47(83-49(73)27(4)13-2)59(25-63)29(20-54(46,5)6)28-14-15-33-55(7)18-17-35(56(8,24-62)32(55)16-19-57(33,9)58(28,10)21-34(59)64)78-53-44(80-52-41(70)39(68)37(66)31(23-61)77-52)42(71)43(45(81-53)50(74)75-11)79-51-40(69)38(67)36(65)30(22-60)76-51/h12-14,29-47,51-53,60-71H,15-25H2,1-11H3/b26-12+,27-13-/t29-,30+,31+,32?,33?,34+,35-,36+,37+,38-,39-,40+,41+,42+,43+,44-,45+,46-,47-,51-,52-,53-,55-,56+,57+,58+,59-/m0/s1 |
| InChIKey | LFHVPGKXRMSZAI-BWNISZONSA-N |
| Literature Reference Author | Z.ZHANG,K.KOIKE,Z.JIA,T.NIKAIDO,D.GUO,J.ZHENG |
| Literature Reference Citation | CHEM.PHARM.BULL.,47,1515(1999) |
| Literature Reference DOI | 10.1248/cpb.47.1515 |
| Molecular Weight | 1185.365 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWLU8363 |