![PUTRANOSIDE-C;3-O-BETA-[RHAMNOPYRANOSYL-(1->3)-(6-O-METHYL)-GLUCURONOPYRANOSYL]-OLEANOLIC-ACID-28-O-GLUCOPYRANOSYLESTER](/api/spectrum/DNQiKGPSeUU/structure.png?h=300&w=458 "PUTRANOSIDE-C;3-O-BETA-[RHAMNOPYRANOSYL-(1->3)-(6-O-METHYL)-GLUCURONOPYRANOSYL]-OLEANOLIC-ACID-28-O-GLUCOPYRANOSYLESTER")
| SpectraBase Compound ID | K0RaYHOYyfN |
|---|---|
| InChI | InChI=1S/C49H78O18/c1-22-29(51)31(53)33(55)40(62-22)65-37-35(57)38(39(59)61-9)66-42(36(37)58)64-28-13-14-46(6)26(45(28,4)5)12-15-48(8)27(46)11-10-23-24-20-44(2,3)16-18-49(24,19-17-47(23,48)7)43(60)67-41-34(56)32(54)30(52)25(21-50)63-41/h10,22,24-38,40-42,50-58H,11-21H2,1-9H3/t22-,24?,25+,26?,27?,28-,29-,30+,31+,32-,33+,34+,35-,36+,37-,38-,40-,41-,42+,46-,47+,48+,49-/m0/s1 |
| InChIKey | JPYCWKKERCUHMD-SXFODHNYSA-N |
| Mol Weight | 955.1 g/mol |
| Molecular Formula | C49H78O18 |
| Exact Mass | 954.518816 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DNQiKGPSeUU |
|---|---|
| Name | OLEANOLIC-ACID-3-O-ALPHA-L-RHAMNOPYRANOSYL-(1->3)-6'-O-METHYL-BETA-D-GLUCURONOPYRANOSYL-28-O-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C49H78O18 |
| InChI | InChI=1S/C49H78O18/c1-22-29(51)31(53)33(55)40(62-22)65-37-35(57)38(39(59)61-9)66-42(36(37)58)64-28-13-14-46(6)26(45(28,4)5)12-15-48(8)27(46)11-10-23-24-20-44(2,3)16-18-49(24,19-17-47(23,48)7)43(60)67-41-34(56)32(54)30(52)25(21-50)63-41/h10,22,24-38,40-42,50-58H,11-21H2,1-9H3/t22-,24?,25+,26?,27?,28-,29-,30+,31+,32-,33+,34+,35-,36+,37-,38-,40-,41-,42+,46-,47+,48+,49-/m0/s1 |
| InChIKey | JPYCWKKERCUHMD-SXFODHNYSA-N |
| Literature Reference Author | F.R.MELEK,T.MIYASE,O.D.EL-GINDI,S.M.ABDEL-KHALIK,M.Y.HAGGAG |
| Literature Reference Citation | PHYTOCHEM.,42,1405(1996) |
| Literature Reference DOI | 10.1016/0031-9422(95)00087-9 |
| Molecular Weight | 955.148 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWVN3111 |