![ZANHASAPONIN-B;3-O-BETA-[GLUCURONOPYRANOSYL]-ZANHIC-ACID-28-O-[XYLOPYRANOSYL-(1->2)-RHAMNOPYRANOSYL-(1->2)-RHAMNOPYRANOSYL]-ESTER](/api/spectrum/L5I6fEOXcM3/structure.png?h=300&w=458 "ZANHASAPONIN-B;3-O-BETA-[GLUCURONOPYRANOSYL]-ZANHIC-ACID-28-O-[XYLOPYRANOSYL-(1->2)-RHAMNOPYRANOSYL-(1->2)-RHAMNOPYRANOSYL]-ESTER")
| SpectraBase Compound ID | 91FWdXEEUaK |
|---|---|
| InChI | InChI=1S/C53H82O25/c1-19-28(57)32(61)38(75-42-35(64)30(59)24(55)18-71-42)44(72-19)76-39-33(62)29(58)20(2)73-45(39)78-47(70)53-14-13-48(3,4)15-22(53)21-9-10-25-49(5)16-23(54)40(77-43-36(65)31(60)34(63)37(74-43)41(66)67)52(8,46(68)69)26(49)11-12-50(25,6)51(21,7)17-27(53)56/h9,19-20,22-40,42-45,54-65H,10-18H2,1-8H3,(H,66,67)(H,68,69)/t19-,20-,22?,23-,24+,25?,26?,27+,28-,29-,30-,31-,32+,33+,34-,35+,36+,37-,38+,39+,40-,42-,43-,44-,45-,49+,50+,51+,52-,53+/m0/s1 |
| InChIKey | AOIMXJGQCIOVFI-DEYCPFJRSA-N |
| Mol Weight | 1119.2 g/mol |
| Molecular Formula | C53H82O25 |
| Exact Mass | 1118.514518 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | L5I6fEOXcM3 |
|---|---|
| Name | ZANHASAPONIN-B;3-O-BETA-[GLUCURONOPYRANOSYL]-ZANHIC-ACID-28-O-[XYLOPYRANOSYL-(1->2)-RHAMNOPYRANOSYL-(1->2)-RHAMNOPYRANOSYL]-ESTER |
| Compound Number | 191 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C53H82O25 |
| InChI | InChI=1S/C53H82O25/c1-19-28(57)32(61)38(75-42-35(64)30(59)24(55)18-71-42)44(72-19)76-39-33(62)29(58)20(2)73-45(39)78-47(70)53-14-13-48(3,4)15-22(53)21-9-10-25-49(5)16-23(54)40(77-43-36(65)31(60)34(63)37(74-43)41(66)67)52(8,46(68)69)26(49)11-12-50(25,6)51(21,7)17-27(53)56/h9,19-20,22-40,42-45,54-65H,10-18H2,1-8H3,(H,66,67)(H,68,69)/t19-,20-,22?,23-,24+,25?,26?,27+,28-,29-,30-,31-,32+,33+,34-,35+,36+,37-,38+,39+,40-,42-,43-,44-,45-,49+,50+,51+,52-,53+/m0/s1 |
| InChIKey | AOIMXJGQCIOVFI-DEYCPFJRSA-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 | 1119.219 g/mol |
| Solvent | Unknown |
| Source File Reference | UWVN1334 |