![ELATOSIDE_B;OLEANOLIC_ACID_3-O-{[BETA-D-GALACTOPYRANOSYL-(1->2)]-[BETA-D-GALACTOPYRANOSYL-(1->3)]}-BETA-D-GLUCOPYRANOSIDURONIC_ACID](/api/spectrum/23ztlhh5OBF/structure.png?h=300&w=458 "ELATOSIDE_B;OLEANOLIC_ACID_3-O-{[BETA-D-GALACTOPYRANOSYL-(1->2)]-[BETA-D-GALACTOPYRANOSYL-(1->3)]}-BETA-D-GLUCOPYRANOSIDURONIC_ACID")
| SpectraBase Compound ID | 1Xcj4p36l22 |
|---|---|
| InChI | InChI=1S/C48H76O19/c1-43(2)14-16-48(42(60)61)17-15-46(6)21(22(48)18-43)8-9-26-45(5)12-11-27(44(3,4)25(45)10-13-47(26,46)7)64-41-37(67-40-33(56)31(54)29(52)24(20-50)63-40)35(34(57)36(66-41)38(58)59)65-39-32(55)30(53)28(51)23(19-49)62-39/h8,22-37,39-41,49-57H,9-20H2,1-7H3,(H,58,59)(H,60,61)/t22-,23-,24+,25+,26+,27-,28+,29-,30+,31-,32-,33+,34+,35+,36+,37-,39+,40-,41-,45-,46+,47+,48-/m0/s1 |
| InChIKey | YDZWHGJRWMQCDP-KVNQHWFOSA-N |
| Mol Weight | 957.1 g/mol |
| Molecular Formula | C48H76O19 |
| Exact Mass | 956.49808 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 23ztlhh5OBF |
|---|---|
| Name | ELATOSIDE_B;OLEANOLIC_ACID_3-O-{[BETA-D-GALACTOPYRANOSYL-(1->2)]-[BETA-D-GALACTOPYRANOSYL-(1->3)]}-BETA-D-GLUCOPYRANOSIDURONIC_ACID |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C48H76O19 |
| InChI | InChI=1S/C48H76O19/c1-43(2)14-16-48(42(60)61)17-15-46(6)21(22(48)18-43)8-9-26-45(5)12-11-27(44(3,4)25(45)10-13-47(26,46)7)64-41-37(67-40-33(56)31(54)29(52)24(20-50)63-40)35(34(57)36(66-41)38(58)59)65-39-32(55)30(53)28(51)23(19-49)62-39/h8,22-37,39-41,49-57H,9-20H2,1-7H3,(H,58,59)(H,60,61)/t22-,23-,24+,25+,26+,27-,28+,29-,30+,31-,32-,33+,34+,35+,36+,37-,39+,40-,41-,45-,46+,47+,48-/m0/s1 |
| InChIKey | YDZWHGJRWMQCDP-KVNQHWFOSA-N |
| Literature Reference Author | M.YOSHIKAWA,T.MURAKAMI,E.HARADA,N.MURAKAMI,J.YAMAHARA,H.MATS UDA |
| Literature Reference Citation | CHEM.PHARM.BULL.,44,1915(1996) |
| Literature Reference DOI | 10.1248/cpb.44.1915 |
| Molecular Weight | 957.120 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMZ17470 |