| SpectraBase Compound ID | DWznAMgB3Jh |
|---|---|
| InChI | InChI=1S/C58H92O29/c1-20-30(65)32(67)36(71)48(80-20)83-41-27(63)18-78-47(39(41)74)82-40-21(2)81-49(38(73)35(40)70)85-43-31(66)26(62)17-79-51(43)87-52(77)58-12-11-53(3,4)13-23(58)22-9-10-28-54(5)14-25(61)45(86-50-37(72)33(68)34(69)42(84-50)46(75)76)55(6,19-59)44(54)24(60)15-57(28,8)56(22,7)16-29(58)64/h9,20-21,23-45,47-51,59-74H,10-19H2,1-8H3,(H,75,76)/t20-,21-,23?,24+,25-,26-,27+,28?,29+,30-,31-,32+,33-,34-,35-,36+,37+,38+,39+,40-,41-,42-,43+,44?,45-,47-,48-,49-,50-,51-,54+,55-,56+,57+,58+/m0/s1 |
| InChIKey | QXLGWIOGISQPDB-VDBRLKEXSA-N |
| Mol Weight | 1253.3 g/mol |
| Molecular Formula | C58H92O29 |
| Exact Mass | 1252.572427 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | F9bZqkrrfYs |
|---|---|
| Name | 3-O-BETA-D-GLUCURONOPYRANOSYL-28-O-[ALPHA-L-RHAMNOPYRANOSYL-(1->3)-BETA-D-XYLOPYRANOSYL-(1->4)-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-ALPHA-L-RHAMNOPYRANOS |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C58H92O29 |
| InChI | InChI=1S/C58H92O29/c1-20-30(65)32(67)36(71)48(80-20)83-41-27(63)18-78-47(39(41)74)82-40-21(2)81-49(38(73)35(40)70)85-43-31(66)26(62)17-79-51(43)87-52(77)58-12-11-53(3,4)13-23(58)22-9-10-28-54(5)14-25(61)45(86-50-37(72)33(68)34(69)42(84-50)46(75)76)55(6,19-59)44(54)24(60)15-57(28,8)56(22,7)16-29(58)64/h9,20-21,23-45,47-51,59-74H,10-19H2,1-8H3,(H,75,76)/t20-,21-,23?,24+,25-,26-,27+,28?,29+,30-,31-,32+,33-,34-,35-,36+,37+,38+,39+,40-,41-,42-,43+,44?,45-,47-,48-,49-,50-,51-,54+,55-,56+,57+,58+/m0/s1 |
| InChIKey | QXLGWIOGISQPDB-VDBRLKEXSA-N |
| Literature Reference Author | C.LAVAUD,G.MASSIOT,M.BECCHI,G.MISRA,S.K.NIGAM |
| Literature Reference Citation | PHYTOCHEM.,41,887(1996) |
| Literature Reference DOI | 10.1016/0031-9422(95)00692-3 |
| Molecular Weight | 1253.351 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWLU4115 |