![28-O-[XYLOPYRANOSYL-(1->4)-RHAMNOPYRANOSYL-(1->4)-[4-ACETOXY-GLUCOPYRANOSYL-(1->2)]-FUCOPYRANOSYL]-QUILLAIC-ACID-ESTER](/api/spectrum/8amcjKpDF9c/structure.png?h=300&w=458 "28-O-[XYLOPYRANOSYL-(1->4)-RHAMNOPYRANOSYL-(1->4)-[4-ACETOXY-GLUCOPYRANOSYL-(1->2)]-FUCOPYRANOSYL]-QUILLAIC-ACID-ESTER")
| SpectraBase Compound ID | 343kONj9lmB |
|---|---|
| InChI | InChI=1S/C55H86O23/c1-23-41(75-45-37(65)34(62)28(59)21-70-45)35(63)38(66)46(71-23)76-42-24(2)72-48(44(40(42)68)77-47-39(67)36(64)43(73-25(3)58)29(20-56)74-47)78-49(69)55-17-16-50(4,5)18-27(55)26-10-11-31-51(6)14-13-32(60)52(7,22-57)30(51)12-15-53(31,8)54(26,9)19-33(55)61/h10,22-24,27-48,56,59-68H,11-21H2,1-9H3/t23-,24+,27?,28-,29+,30?,31?,32-,33+,34+,35-,36+,37-,38+,39+,40-,41-,42-,43+,44+,45+,46-,47-,48-,51-,52-,53+,54+,55+/m0/s1 |
| InChIKey | RGYQFTSOIAXNPD-XHGAEKMXSA-N |
| Mol Weight | 1115.3 g/mol |
| Molecular Formula | C55H86O23 |
| Exact Mass | 1114.555989 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8amcjKpDF9c |
|---|---|
| Name | 28-O-[XYLOPYRANOSYL-(1->4)-RHAMNOPYRANOSYL-(1->4)-[4-ACETOXY-GLUCOPYRANOSYL-(1->2)]-FUCOPYRANOSYL]-QUILLAIC-ACID-ESTER |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C55H86O23 |
| InChI | InChI=1S/C55H86O23/c1-23-41(75-45-37(65)34(62)28(59)21-70-45)35(63)38(66)46(71-23)76-42-24(2)72-48(44(40(42)68)77-47-39(67)36(64)43(73-25(3)58)29(20-56)74-47)78-49(69)55-17-16-50(4,5)18-27(55)26-10-11-31-51(6)14-13-32(60)52(7,22-57)30(51)12-15-53(31,8)54(26,9)19-33(55)61/h10,22-24,27-48,56,59-68H,11-21H2,1-9H3/t23-,24+,27?,28-,29+,30?,31?,32-,33+,34+,35-,36+,37-,38+,39+,40-,41-,42-,43+,44+,45+,46-,47-,48-,51-,52-,53+,54+,55+/m0/s1 |
| InChIKey | RGYQFTSOIAXNPD-XHGAEKMXSA-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 | 1115.274 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWVN1306 |