![28-O-[XYLOPYRANOSYL-(1->3)-XYLOPYRANOSYL-(1->4)-RHAMNOPYRANOSYL-(1->2)-[RHAMNOPYRANOSYL-(1->3)]-XYLOPYRANOSYL]-ECHINOCYSTIC-ACID-ESTER](/api/spectrum/GKz0V9U4APS/structure.png?h=300&w=458 "28-O-[XYLOPYRANOSYL-(1->3)-XYLOPYRANOSYL-(1->4)-RHAMNOPYRANOSYL-(1->2)-[RHAMNOPYRANOSYL-(1->3)]-XYLOPYRANOSYL]-ECHINOCYSTIC-ACID-ESTER")
| SpectraBase Compound ID | 5HFGi33Wwho |
|---|---|
| InChI | InChI=1S/C57H92O24/c1-23-34(63)36(65)39(68)48(75-23)79-44-29(60)22-74-50(45(44)80-49-40(69)37(66)42(24(2)76-49)77-47-41(70)43(28(59)21-73-47)78-46-38(67)35(64)27(58)20-72-46)81-51(71)57-17-16-52(3,4)18-26(57)25-10-11-31-54(7)14-13-32(61)53(5,6)30(54)12-15-55(31,8)56(25,9)19-33(57)62/h10,23-24,26-50,58-70H,11-22H2,1-9H3/t23-,24+,26?,27+,28+,29-,30?,31?,32+,33-,34-,35-,36+,37+,38+,39+,40-,41+,42+,43-,44+,45-,46-,47-,48-,49+,50+,54+,55-,56-,57-/m1/s1 |
| InChIKey | JJEVGWZWMQCOHJ-LGBXKGNJSA-N |
| Mol Weight | 1161.3 g/mol |
| Molecular Formula | C57H92O24 |
| Exact Mass | 1160.597854 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GKz0V9U4APS |
|---|---|
| Name | 28-O-[XYLOPYRANOSYL-(1->3)-XYLOPYRANOSYL-(1->4)-RHAMNOPYRANOSYL-(1->2)-[RHAMNOPYRANOSYL-(1->3)]-XYLOPYRANOSYL]-ECHINOCYSTIC-ACID-ESTER |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C57H92O24 |
| InChI | InChI=1S/C57H92O24/c1-23-34(63)36(65)39(68)48(75-23)79-44-29(60)22-74-50(45(44)80-49-40(69)37(66)42(24(2)76-49)77-47-41(70)43(28(59)21-73-47)78-46-38(67)35(64)27(58)20-72-46)81-51(71)57-17-16-52(3,4)18-26(57)25-10-11-31-54(7)14-13-32(61)53(5,6)30(54)12-15-55(31,8)56(25,9)19-33(57)62/h10,23-24,26-50,58-70H,11-22H2,1-9H3/t23-,24+,26?,27+,28+,29-,30?,31?,32+,33-,34-,35-,36+,37+,38+,39+,40-,41+,42+,43-,44+,45-,46-,47-,48-,49+,50+,54+,55-,56-,57-/m1/s1 |
| InChIKey | JJEVGWZWMQCOHJ-LGBXKGNJSA-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 | 1161.343 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWVN1013 |