![ARALIASAPONIN-XIII;3-O-BETA-D-GLUCOPYRANOSYL-(1->3)-[BETA-D-XYLOPYRANOSYL-(1->2)]-ALPHA-L-ARABINOPYRANOSYL-OLEANOLIC-ACID-28-O-ALPHA-L-RHAMN](/api/spectrum/JyxvqixH6Uk/structure.png?h=300&w=458 "ARALIASAPONIN-XIII;3-O-BETA-D-GLUCOPYRANOSYL-(1->3)-[BETA-D-XYLOPYRANOSYL-(1->2)]-ALPHA-L-ARABINOPYRANOSYL-OLEANOLIC-ACID-28-O-ALPHA-L-RHAMN")
| SpectraBase Compound ID | Kh7W4rVdrJA |
|---|---|
| InChI | InChI=1S/C64H104O30/c1-25-36(69)40(73)45(78)54(86-25)92-50-31(21-66)88-52(48(81)43(50)76)85-24-32-39(72)42(75)47(80)56(89-32)94-58(82)64-17-15-59(2,3)19-27(64)26-9-10-34-61(6)13-12-35(60(4,5)33(61)11-14-63(34,8)62(26,7)16-18-64)90-57-51(93-53-44(77)37(70)28(67)22-83-53)49(29(68)23-84-57)91-55-46(79)41(74)38(71)30(20-65)87-55/h9,25,27-57,65-81H,10-24H2,1-8H3/t25-,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-,52-,53+,54-,55+,56+,57+,61?,62?,63?,64?/m1/s1 |
| InChIKey | QPGKEEQBTWJHIK-UNKJVSTDSA-N |
| Mol Weight | 1353.5 g/mol |
| Molecular Formula | C64H104O30 |
| Exact Mass | 1352.661242 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JyxvqixH6Uk |
|---|---|
| Name | ARALIASAPONIN-XIII;3-O-BETA-D-GLUCOPYRANOSYL-(1->3)-[BETA-D-XYLOPYRANOSYL-(1->2)]-ALPHA-L-ARABINOPYRANOSYL-OLEANOLIC-ACID-28-O-ALPHA-L-RHAMN |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C64H104O30 |
| InChI | InChI=1S/C64H104O30/c1-25-36(69)40(73)45(78)54(86-25)92-50-31(21-66)88-52(48(81)43(50)76)85-24-32-39(72)42(75)47(80)56(89-32)94-58(82)64-17-15-59(2,3)19-27(64)26-9-10-34-61(6)13-12-35(60(4,5)33(61)11-14-63(34,8)62(26,7)16-18-64)90-57-51(93-53-44(77)37(70)28(67)22-83-53)49(29(68)23-84-57)91-55-46(79)41(74)38(71)30(20-65)87-55/h9,25,27-57,65-81H,10-24H2,1-8H3/t25-,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-,52-,53+,54-,55+,56+,57+,61?,62?,63?,64?/m1/s1 |
| InChIKey | QPGKEEQBTWJHIK-UNKJVSTDSA-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 | 1353.512 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWVN2962 |