![SAPONIN-B;3-O-BETA-[RHAMNOPYRANOSYL-(1->4)-GLUCOPYRANOSYL-(1->4)-(6-O-METHYL)-GLUCURONOPYRANOSYL]-OLEANOLIC-ACID-28-O-GALACTOPYRANOSYLESTER](/api/spectrum/GvLrRCZYN0H/structure.png?h=300&w=458 "SAPONIN-B;3-O-BETA-[RHAMNOPYRANOSYL-(1->4)-GLUCOPYRANOSYL-(1->4)-(6-O-METHYL)-GLUCURONOPYRANOSYL]-OLEANOLIC-ACID-28-O-GALACTOPYRANOSYLESTER")
| SpectraBase Compound ID | IVIwSKlqZjU |
|---|---|
| InChI | InChI=1S/C55H88O23/c1-23-31(58)33(60)37(64)45(71-23)75-41-27(22-57)73-46(39(66)35(41)62)76-42-36(63)40(67)48(77-43(42)44(68)70-9)74-30-13-14-52(6)28(51(30,4)5)12-15-54(8)29(52)11-10-24-25-20-50(2,3)16-18-55(25,19-17-53(24,54)7)49(69)78-47-38(65)34(61)32(59)26(21-56)72-47/h10,23,25-43,45-48,56-67H,11-22H2,1-9H3/t23-,25?,26+,27-,28?,29?,30-,31-,32-,33+,34-,35-,36+,37+,38+,39-,40+,41-,42-,43-,45-,46+,47-,48+,52-,53+,54+,55-/m0/s1 |
| InChIKey | RZWXACWYTTVDAN-GSDJHBFLSA-N |
| Mol Weight | 1117.3 g/mol |
| Molecular Formula | C55H88O23 |
| Exact Mass | 1116.571639 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GvLrRCZYN0H |
|---|---|
| Name | SAPONIN-B;3-O-BETA-[RHAMNOPYRANOSYL-(1->4)-GLUCOPYRANOSYL-(1->4)-(6-O-METHYL)-GLUCURONOPYRANOSYL]-OLEANOLIC-ACID-28-O-GALACTOPYRANOSYLESTER |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C55H88O23 |
| InChI | InChI=1S/C55H88O23/c1-23-31(58)33(60)37(64)45(71-23)75-41-27(22-57)73-46(39(66)35(41)62)76-42-36(63)40(67)48(77-43(42)44(68)70-9)74-30-13-14-52(6)28(51(30,4)5)12-15-54(8)29(52)11-10-24-25-20-50(2,3)16-18-55(25,19-17-53(24,54)7)49(69)78-47-38(65)34(61)32(59)26(21-56)72-47/h10,23,25-43,45-48,56-67H,11-22H2,1-9H3/t23-,25?,26+,27-,28?,29?,30-,31-,32-,33+,34-,35-,36+,37+,38+,39-,40+,41-,42-,43-,45-,46+,47-,48+,52-,53+,54+,55-/m0/s1 |
| InChIKey | RZWXACWYTTVDAN-GSDJHBFLSA-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 | 1117.290 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWVN1217 |