SpectraBase Compound ID | GYXXtjQWRrA |
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InChI | InChI=1S/C58H90O22/c1-13-25(3)48(71)79-45-46(80-49(72)26(4)14-2)58(24-60)29(21-53(45,6)7)28-15-16-32-55(10)19-18-34(54(8,9)31(55)17-20-56(32,11)57(28,12)22-33(58)61)75-52-44(78-51-40(67)38(65)36(63)30(23-59)74-51)42(41(68)43(77-52)47(69)70)76-50-39(66)37(64)35(62)27(5)73-50/h13-15,27,29-46,50-52,59-68H,16-24H2,1-12H3,(H,69,70)/b25-13-,26-14-/t27-,29-,30-,31-,32+,33+,34-,35-,36+,37+,38+,39+,40-,41-,42-,43-,44+,45-,46-,50-,51+,52+,55-,56+,57+,58-/m0/s1 |
InChIKey | FESOGIOEJQIMMJ-CXNXLKJJSA-N |
Mol Weight | 1139.3 g/mol |
Molecular Formula | C58H90O22 |
Exact Mass | 1138.592375 g/mol |
SpectraBase Spectrum ID | 7sIPSpUoMrs |
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Name | 3-O-ALPHA-L-RHAMNOPYRANOSYL-(1->3)-[BETA-D-GALACTOPYRANOSYL-(1->2)]-BETA-D-GLUCURONOPYRANOSYL-21-BETA,22-ALPHA-DI-O-ANGELOYL-BARRINGTOGENOL-C |
Compound Number | 2 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C58H90O22 |
InChI | InChI=1S/C58H90O22/c1-13-25(3)48(71)79-45-46(80-49(72)26(4)14-2)58(24-60)29(21-53(45,6)7)28-15-16-32-55(10)19-18-34(54(8,9)31(55)17-20-56(32,11)57(28,12)22-33(58)61)75-52-44(78-51-40(67)38(65)36(63)30(23-59)74-51)42(41(68)43(77-52)47(69)70)76-50-39(66)37(64)35(62)27(5)73-50/h13-15,27,29-46,50-52,59-68H,16-24H2,1-12H3,(H,69,70)/b25-13-,26-14-/t27-,29-,30-,31-,32+,33+,34-,35-,36+,37+,38+,39+,40-,41-,42-,43-,44+,45-,46-,50-,51+,52+,55-,56+,57+,58-/m0/s1 |
InChIKey | FESOGIOEJQIMMJ-CXNXLKJJSA-N |
Literature Reference Author | L.VOUTQUENNE,P.GUINOT,C.FROISSARD,O.THOISON,M.LITAUDON,C.LAV AUD |
Literature Reference Citation | PHYTOCHEM.,66,825(2005) |
Literature Reference DOI | 10.1016/j.phytochem.2005.02.009 |
Molecular Weight | 1139.339 g/mol |
Solvent | CD3OD |
Source File Reference | UWLU32546 |