![FRONDOSIDE-A2-3;3-O-[3-O-METHYL-BETA-D-GLUCOPYRANOSYL-(1->3)-BETA-D-GLUCOPYRANOSYL-(1->4)-[BETA-D-XYLOPYRANOSYL-(1->2)]-BETA-D-QUINOVOPYRANOSYL-(1-](/api/spectrum/FN0HHzy0O2a/structure.png?h=300&w=458 "FRONDOSIDE-A2-3;3-O-[3-O-METHYL-BETA-D-GLUCOPYRANOSYL-(1->3)-BETA-D-GLUCOPYRANOSYL-(1->4)-[BETA-D-XYLOPYRANOSYL-(1->2)]-BETA-D-QUINOVOPYRANOSYL-(1-")
| SpectraBase Compound ID | G5iHh4o3O61 |
|---|---|
| InChI | InChI=1S/C59H94O29S.Na/c1-25-43(83-50-42(70)45(37(65)30(22-61)81-50)84-49-41(69)44(76-9)36(64)29(21-60)80-49)40(68)47(85-48-39(67)35(63)28(62)23-77-48)52(79-25)86-46-38(66)31(88-89(73,74)75)24-78-51(46)82-34-15-18-56(6)26-13-20-59-33(58(8,87-53(59)71)17-10-16-54(2,3)72)14-19-57(59,7)27(26)11-12-32(56)55(34,4)5;/h10-11,16,25-26,28-52,60-70,72H,12-15,17-24H2,1-9H3,(H,73,74,75);/q;+1/p-1/b16-10+;/t25-,26?,28-,29+,30+,31-,32?,33?,34?,35+,36+,37+,38+,39-,40+,41+,42+,43-,44-,45-,46-,47-,48+,49-,50-,51+,52+,56-,57+,58+,59?;/m1./s1 |
| InChIKey | BFKJXBXHZMLYGL-RILHRJQCSA-M |
| Mol Weight | 1321.4 g/mol |
| Molecular Formula | C59H93NaO29S |
| Exact Mass | 1320.542092 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FN0HHzy0O2a |
|---|---|
| Name | FRONDOSIDE-A2-3;3-O-[3-O-METHYL-BETA-D-GLUCOPYRANOSYL-(1->3)-BETA-D-GLUCOPYRANOSYL-(1->4)-[BETA-D-XYLOPYRANOSYL-(1->2)]-BETA-D-QUINOVOPYRANOSYL-(1- |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C59H93NaO29S |
| InChI | InChI=1S/C59H94O29S.Na/c1-25-43(83-50-42(70)45(37(65)30(22-61)81-50)84-49-41(69)44(76-9)36(64)29(21-60)80-49)40(68)47(85-48-39(67)35(63)28(62)23-77-48)52(79-25)86-46-38(66)31(88-89(73,74)75)24-78-51(46)82-34-15-18-56(6)26-13-20-59-33(58(8,87-53(59)71)17-10-16-54(2,3)72)14-19-57(59,7)27(26)11-12-32(56)55(34,4)5;/h10-11,16,25-26,28-52,60-70,72H,12-15,17-24H2,1-9H3,(H,73,74,75);/q;+1/p-1/b16-10+;/t25-,26?,28-,29+,30+,31-,32?,33?,34?,35+,36+,37+,38+,39-,40+,41+,42+,43-,44-,45-,46-,47-,48+,49-,50-,51+,52+,56-,57+,58+,59?;/m1./s1 |
| InChIKey | BFKJXBXHZMLYGL-RILHRJQCSA-M |
| Literature Reference Author | A.S.SILCHENKO,S.A.AVILOV,A.S.ANTONOV,A.I.KALINOVSKY,P.S.DMIT RENOK,V.I.KALINI,V.A |
| Literature Reference Citation | CAN.J.CHEM.,83,21(2005) |
| Literature Reference DOI | 10.1139/v04-163 |
| Molecular Weight | 1321.420 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWVN27449 |