![3-O-[BETA-D-GALACTOPYRANOSYL-(1->2)-BETA-D-GLUCURONOPYRANOSYL]-28-O-[BETA-D-GLUCOPYRANOSYL-(1->2)-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-BETA-D-FUCOPYRANOS](/api/spectrum/LFXWeJHcodj/structure.png?h=300&w=458 "3-O-[BETA-D-GALACTOPYRANOSYL-(1->2)-BETA-D-GLUCURONOPYRANOSYL]-28-O-[BETA-D-GLUCOPYRANOSYL-(1->2)-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-BETA-D-FUCOPYRANOS")
| SpectraBase Compound ID | 1iQNCkDPl6H |
|---|---|
| InChI | InChI=1S/C60H94O29/c1-22-32(65)38(71)45(86-49-42(75)36(69)34(67)26(19-61)82-49)51(80-22)88-46-39(72)33(66)23(2)81-52(46)89-54(79)60-16-15-55(3,4)17-25(60)24-9-10-29-56(5)13-12-31(57(6,21-63)28(56)11-14-58(29,7)59(24,8)18-30(60)64)84-53-47(41(74)40(73)44(85-53)48(77)78)87-50-43(76)37(70)35(68)27(20-62)83-50/h9,21-23,25-47,49-53,61-62,64-76H,10-20H2,1-8H3,(H,77,78)/t22-,23+,25?,26+,27+,28?,29?,30+,31-,32-,33-,34+,35-,36-,37-,38+,39-,40-,41-,42+,43+,44-,45+,46+,47+,49-,50-,51-,52-,53+,56-,57-,58+,59+,60+/m0/s1 |
| InChIKey | JCOQMASYAXEGJU-CDLBMXSTSA-N |
| Mol Weight | 1279.4 g/mol |
| Molecular Formula | C60H94O29 |
| Exact Mass | 1278.588077 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LFXWeJHcodj |
|---|---|
| Name | 3-O-[BETA-D-GALACTOPYRANOSYL-(1->2)-BETA-D-GLUCURONOPYRANOSYL]-28-O-[BETA-D-GLUCOPYRANOSYL-(1->2)-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-BETA-D-FUCOPYRANOS |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C60H94O29 |
| InChI | InChI=1S/C60H94O29/c1-22-32(65)38(71)45(86-49-42(75)36(69)34(67)26(19-61)82-49)51(80-22)88-46-39(72)33(66)23(2)81-52(46)89-54(79)60-16-15-55(3,4)17-25(60)24-9-10-29-56(5)13-12-31(57(6,21-63)28(56)11-14-58(29,7)59(24,8)18-30(60)64)84-53-47(41(74)40(73)44(85-53)48(77)78)87-50-43(76)37(70)35(68)27(20-62)83-50/h9,21-23,25-47,49-53,61-62,64-76H,10-20H2,1-8H3,(H,77,78)/t22-,23+,25?,26+,27+,28?,29?,30+,31-,32-,33-,34+,35-,36-,37-,38+,39-,40-,41-,42+,43+,44-,45+,46+,47+,49-,50-,51-,52-,53+,56-,57-,58+,59+,60+/m0/s1 |
| InChIKey | JCOQMASYAXEGJU-CDLBMXSTSA-N |
| Literature Reference Author | M.A.LACAILLE-DUBOIS,B.HANQUET,Z.H.CUI,Z.C.LOU,H.WAGNER |
| Literature Reference Citation | PHYTOCHEM.,40,509(1995) |
| Literature Reference DOI | 10.1016/0031-9422(95)00222-S |
| Molecular Weight | 1279.389 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWVN3581 |