![SAPONIN-15;3-O-BETA-[GALACTOPYRANOSYL-(1->3)-(6-O-METHYL)-GLUCURONOPYRANOSYL]-OLEANOLIC-ACID-28-O-GLUCOPYRANOSYLESTER](/api/spectrum/CSz74Lfq60m/structure.png?h=300&w=458 "SAPONIN-15;3-O-BETA-[GALACTOPYRANOSYL-(1->3)-(6-O-METHYL)-GLUCURONOPYRANOSYL]-OLEANOLIC-ACID-28-O-GLUCOPYRANOSYLESTER")
| SpectraBase Compound ID | ABtqAtbz9Zd |
|---|---|
| InChI | InChI=1S/C49H78O19/c1-44(2)15-17-49(43(61)68-41-34(57)32(55)30(53)25(21-51)64-41)18-16-47(6)22(23(49)19-44)9-10-27-46(5)13-12-28(45(3,4)26(46)11-14-48(27,47)7)65-42-36(59)37(35(58)38(67-42)39(60)62-8)66-40-33(56)31(54)29(52)24(20-50)63-40/h9,23-38,40-42,50-59H,10-21H2,1-8H3/t23?,24-,25-,26?,27?,28+,29+,30-,31+,32+,33-,34-,35+,36-,37+,38+,40+,41+,42-,46+,47-,48-,49+/m1/s1 |
| InChIKey | FBNHNCMZFHURCE-FRTWBEQDSA-N |
| Mol Weight | 971.1 g/mol |
| Molecular Formula | C49H78O19 |
| Exact Mass | 970.51373 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CSz74Lfq60m |
|---|---|
| Name | SAPONIN-15;3-O-BETA-[GALACTOPYRANOSYL-(1->3)-(6-O-METHYL)-GLUCURONOPYRANOSYL]-OLEANOLIC-ACID-28-O-GLUCOPYRANOSYLESTER |
| Compound Number | 12 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C49H78O19 |
| InChI | InChI=1S/C49H78O19/c1-44(2)15-17-49(43(61)68-41-34(57)32(55)30(53)25(21-51)64-41)18-16-47(6)22(23(49)19-44)9-10-27-46(5)13-12-28(45(3,4)26(46)11-14-48(27,47)7)65-42-36(59)37(35(58)38(67-42)39(60)62-8)66-40-33(56)31(54)29(52)24(20-50)63-40/h9,23-38,40-42,50-59H,10-21H2,1-8H3/t23?,24-,25-,26?,27?,28+,29+,30-,31+,32+,33-,34-,35+,36-,37+,38+,40+,41+,42-,46+,47-,48-,49+/m1/s1 |
| InChIKey | FBNHNCMZFHURCE-FRTWBEQDSA-N |
| Literature Reference Author | N.TAN,J.ZHOU,S.ZHAO |
| Literature Reference Citation | PHYTOCHEM.,52,153(1999) |
| Literature Reference DOI | 10.1016/S0031-9422(98)00454-3 |
| Molecular Weight | 971.147 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWVN1219 |