| SpectraBase Compound ID | I0RJHupMTyR |
|---|---|
| InChI | InChI=1S/C48H78O18/c1-43(2)14-16-48(42(60)66-40-36(58)34(56)31(53)25(20-50)62-40)17-15-46(6)22(23(48)18-43)8-9-28-45(5)12-11-29(44(3,4)27(45)10-13-47(28,46)7)64-41-37(59)38(32(54)26(21-51)63-41)65-39-35(57)33(55)30(52)24(19-49)61-39/h8,23-41,49-59H,9-21H2,1-7H3/t23?,24-,25-,26-,27?,28?,29+,30-,31-,32-,33+,34+,35-,36-,37-,38+,39+,40+,41+,45+,46-,47-,48+/m1/s1 |
| InChIKey | MHCDFIFLMYBWIV-DEYFCAECSA-N |
| Mol Weight | 943.1 g/mol |
| Molecular Formula | C48H78O18 |
| Exact Mass | 942.518816 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FpyroIOX5Pv |
|---|---|
| Name | 3-O-BETA-D-GLUCOPYRANOSYL-(1->3)-BETA-D-GLUCOPYRANOSYL-28-O-BETA-D-GLUCOPYRANOSYL-OLEANOLIC-ACID |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C48H78O18 |
| InChI | InChI=1S/C48H78O18/c1-43(2)14-16-48(42(60)66-40-36(58)34(56)31(53)25(20-50)62-40)17-15-46(6)22(23(48)18-43)8-9-28-45(5)12-11-29(44(3,4)27(45)10-13-47(28,46)7)64-41-37(59)38(32(54)26(21-51)63-41)65-39-35(57)33(55)30(52)24(19-49)61-39/h8,23-41,49-59H,9-21H2,1-7H3/t23?,24-,25-,26-,27?,28?,29+,30-,31-,32-,33+,34+,35-,36-,37-,38+,39+,40+,41+,45+,46-,47-,48+/m1/s1 |
| InChIKey | MHCDFIFLMYBWIV-DEYFCAECSA-N |
| Literature Reference Author | U.L.B.JAYASINGHE,C.P.JAYASOORIYA,Y.FUJIMOTO |
| Literature Reference Citation | FITOTERAPIA,73,406(2002) |
| Literature Reference DOI | 10.1016/S0367-326X(02)00123-5 |
| Molecular Weight | 943.137 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWVN4153 |