![#1;LEUCANTHOSIDE-A;3-O-[BETA-D-XYLOPYRANOSYL-(1->3)-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-ALPHA-L-ARABINOPYRANOSYL]-28-O-[BETA-D-ALLOPYRANOSYL-(1->6)-BETA-D-GLUCOPYRA](/api/spectrum/6HXEsQwm6WL/structure.png?h=300&w=458 "#1;LEUCANTHOSIDE-A;3-O-[BETA-D-XYLOPYRANOSYL-(1->3)-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-ALPHA-L-ARABINOPYRANOSYL]-28-O-[BETA-D-ALLOPYRANOSYL-(1->6)-BETA-D-GLUCOPYRA")
| SpectraBase Compound ID | AvYj1yxwkpn |
|---|---|
| InChI | InChI=1S/C58H94O26/c1-24-34(63)45(82-48-41(70)35(64)27(61)20-75-48)44(73)50(78-24)83-46-36(65)28(62)21-76-51(46)81-33-11-12-54(4)31(55(33,5)23-60)10-13-57(7)32(54)9-8-25-26-18-53(2,3)14-16-58(26,17-15-56(25,57)6)52(74)84-49-43(72)40(69)38(67)30(80-49)22-77-47-42(71)39(68)37(66)29(19-59)79-47/h8,24,26-51,59-73H,9-23H2,1-7H3/t24-,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-,51-,54-,55-,56+,57+,58-/m0/s1 |
| InChIKey | DQDTUCJCIHGIOL-JSRQYMLISA-N |
| Mol Weight | 1207.4 g/mol |
| Molecular Formula | C58H94O26 |
| Exact Mass | 1206.603333 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6HXEsQwm6WL |
|---|---|
| Name | #1;LEUCANTHOSIDE-A;3-O-[BETA-D-XYLOPYRANOSYL-(1->3)-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-ALPHA-L-ARABINOPYRANOSYL]-28-O-[BETA-D-ALLOPYRANOSYL-(1->6)-BETA-D-GLUCOPYRA |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C58H94O26 |
| InChI | InChI=1S/C58H94O26/c1-24-34(63)45(82-48-41(70)35(64)27(61)20-75-48)44(73)50(78-24)83-46-36(65)28(62)21-76-51(46)81-33-11-12-54(4)31(55(33,5)23-60)10-13-57(7)32(54)9-8-25-26-18-53(2,3)14-16-58(26,17-15-56(25,57)6)52(74)84-49-43(72)40(69)38(67)30(80-49)22-77-47-42(71)39(68)37(66)29(19-59)79-47/h8,24,26-51,59-73H,9-23H2,1-7H3/t24-,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-,51-,54-,55-,56+,57+,58-/m0/s1 |
| InChIKey | DQDTUCJCIHGIOL-JSRQYMLISA-N |
| Literature Reference Author | D.GODEVAC,B.MANDIC,V.VAJS,N.MENKOVIC,S.MACURA,S.MILOSAVLJEVI C |
| Literature Reference Citation | MAGN.RES.CHEM.,44,731(2006) |
| Literature Reference DOI | 10.1002/mrc.1834 |
| Molecular Weight | 1207.369 g/mol |
| Sample ID | 63605 |
| Solvent | CD3OD |