![3-O-[BETA-D-GALACTOPYRANOSYL-(1->3)-BETA-D-GLUCURONOPYRANOSYL]-28-O-[BETA-D-GLUCOPYRANOSYL-(1->4)-BETA-D-GLUCOPYRANOSYL]-OLEANOLIC-ACID](/api/spectrum/E90bb4VgxqQ/structure.png?h=300&w=458 "3-O-[BETA-D-GALACTOPYRANOSYL-(1->3)-BETA-D-GLUCURONOPYRANOSYL]-28-O-[BETA-D-GLUCOPYRANOSYL-(1->4)-BETA-D-GLUCOPYRANOSYL]-OLEANOLIC-ACID")
| SpectraBase Compound ID | KrmbJ04Ot9s |
|---|---|
| InChI | InChI=1S/C54H86O24/c1-49(2)14-16-54(48(70)78-46-37(65)34(62)40(26(21-57)73-46)75-44-35(63)32(60)30(58)24(19-55)71-44)17-15-52(6)22(23(54)18-49)8-9-28-51(5)12-11-29(50(3,4)27(51)10-13-53(28,52)7)74-47-39(67)41(38(66)42(77-47)43(68)69)76-45-36(64)33(61)31(59)25(20-56)72-45/h8,23-42,44-47,55-67H,9-21H2,1-7H3,(H,68,69)/t23-,24-,25+,26+,27-,28+,29-,30-,31-,32+,33-,34+,35-,36+,37+,38-,39+,40+,41-,42-,44+,45-,46-,47+,51-,52+,53+,54-/m0/s1 |
| InChIKey | HDJJZJJGXRPEQU-HPKLSWEWSA-N |
| Mol Weight | 1119.3 g/mol |
| Molecular Formula | C54H86O24 |
| Exact Mass | 1118.550904 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | E90bb4VgxqQ |
|---|---|
| Name | 3-O-[BETA-D-GALACTOPYRANOSYL-(1->3)-BETA-D-GLUCURONOPYRANOSYL]-28-O-[BETA-D-GLUCOPYRANOSYL-(1->4)-BETA-D-GLUCOPYRANOSYL]-OLEANOLIC-ACID |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C54H86O24 |
| InChI | InChI=1S/C54H86O24/c1-49(2)14-16-54(48(70)78-46-37(65)34(62)40(26(21-57)73-46)75-44-35(63)32(60)30(58)24(19-55)71-44)17-15-52(6)22(23(54)18-49)8-9-28-51(5)12-11-29(50(3,4)27(51)10-13-53(28,52)7)74-47-39(67)41(38(66)42(77-47)43(68)69)76-45-36(64)33(61)31(59)25(20-56)72-45/h8,23-42,44-47,55-67H,9-21H2,1-7H3,(H,68,69)/t23-,24-,25+,26+,27-,28+,29-,30-,31-,32+,33-,34+,35-,36+,37+,38-,39+,40+,41-,42-,44+,45-,46-,47+,51-,52+,53+,54-/m0/s1 |
| InChIKey | HDJJZJJGXRPEQU-HPKLSWEWSA-N |
| Literature Reference Author | A.L.TAPONDJOU,T.MIYAMOTO,M.A.LACAILLE-DUBOIS |
| Literature Reference Citation | PHYTOCHEM.,67,2126(2006) |
| Literature Reference DOI | 10.1016/j.phytochem.2006.06.034 |
| Molecular Weight | 1119.262 g/mol |
| Sample ID | 67130 |
| Solvent | C5D5N |