![ARALIASAPONIN-XVIII-METHYLESTER;3-O-ALPHA-L-ARABINOFURANOSYL-(1->4)-[BETA-D-GLUCOPYRANOSYL-(1->2)]-BETA-D-GLUCURONOPYRANOSYL-OLEANOLIC-ACID-28](/api/spectrum/FIDsRlUZBsm/structure.png?h=300&w=458 "ARALIASAPONIN-XVIII-METHYLESTER;3-O-ALPHA-L-ARABINOFURANOSYL-(1->4)-[BETA-D-GLUCOPYRANOSYL-(1->2)]-BETA-D-GLUCURONOPYRANOSYL-OLEANOLIC-ACID-28")
| SpectraBase Compound ID | DMjIdqEAtJY |
|---|---|
| InChI | InChI=1S/C60H96O28/c1-55(2)15-17-60(54(77)88-52-43(74)39(70)36(67)29(83-52)23-79-49-41(72)37(68)33(64)26(20-61)80-49)18-16-58(6)24(25(60)19-55)9-10-31-57(5)13-12-32(56(3,4)30(57)11-14-59(31,58)7)84-53-46(86-51-42(73)38(69)34(65)27(21-62)81-51)44(75)45(47(87-53)48(76)78-8)85-50-40(71)35(66)28(22-63)82-50/h9,25-47,49-53,61-75H,10-23H2,1-8H3/t25?,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-,57?,58?,59?,60?/m1/s1 |
| InChIKey | VTPKPCXSSRHFKT-ADVWPZNLSA-N |
| Mol Weight | 1265.4 g/mol |
| Molecular Formula | C60H96O28 |
| Exact Mass | 1264.608812 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FIDsRlUZBsm |
|---|---|
| Name | ARALIASAPONIN-XVIII-METHYLESTER;3-O-ALPHA-L-ARABINOFURANOSYL-(1->4)-[BETA-D-GLUCOPYRANOSYL-(1->2)]-BETA-D-GLUCURONOPYRANOSYL-OLEANOLIC-ACID-28 |
| Compound Number | 17 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C60H96O28 |
| InChI | InChI=1S/C60H96O28/c1-55(2)15-17-60(54(77)88-52-43(74)39(70)36(67)29(83-52)23-79-49-41(72)37(68)33(64)26(20-61)80-49)18-16-58(6)24(25(60)19-55)9-10-31-57(5)13-12-32(56(3,4)30(57)11-14-59(31,58)7)84-53-46(86-51-42(73)38(69)34(65)27(21-62)81-51)44(75)45(47(87-53)48(76)78-8)85-50-40(71)35(66)28(22-63)82-50/h9,25-47,49-53,61-75H,10-23H2,1-8H3/t25?,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-,57?,58?,59?,60?/m1/s1 |
| InChIKey | VTPKPCXSSRHFKT-ADVWPZNLSA-N |
| Literature Reference Author | T.MIYASE,N.SUTOH,D.M.ZHANG,A.UENO |
| Literature Reference Citation | PHYTOCHEM.,42,1123(1996) |
| Literature Reference DOI | 10.1016/0031-9422(96)00085-4 |
| Molecular Weight | 1265.405 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWVN2967 |