SpectraBase Compound ID | 2xyxNeD3hRb |
---|---|
InChI | InChI=1S/C52H82O22/c1-10-21(2)43(67)74-41-40(64)47(3,4)17-23-22-11-12-27-49(7)15-14-28(48(5,6)26(49)13-16-50(27,8)51(22,9)38(62)39(63)52(23,41)20-54)70-46-37(73-45-33(60)31(58)30(57)25(18-53)69-45)35(34(61)36(72-46)42(65)66)71-44-32(59)29(56)24(55)19-68-44/h10-11,23-41,44-46,53-64H,12-20H2,1-9H3,(H,65,66)/b21-10-/t23-,24+,25-,26-,27+,28-,29-,30-,31+,32+,33-,34-,35-,36-,37+,38-,39+,40-,41-,44-,45+,46+,49-,50+,51-,52-/m0/s1 |
InChIKey | LONAMHVSUGUOBB-MJSFBVFZSA-N |
Mol Weight | 1059.2 g/mol |
Molecular Formula | C52H82O22 |
Exact Mass | 1058.529774 g/mol |
SpectraBase Spectrum ID | a6JfHTkoIf |
---|---|
Name | #8;ERYNGIOSIDE-E;22-ALPHA-ANGELOYLOXY-3-BETA-[BETA-D-GLUCOPYRANOSYL-(1->2)]-[BETA-D-XYLOPYRANOSYL-(1->3)]-BETA-D-GLUCORONOPYRANOSYLOXY-OLEAN-12-ENE-15-ALPHA,16 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C52H82O22 |
InChI | InChI=1S/C52H82O22/c1-10-21(2)43(67)74-41-40(64)47(3,4)17-23-22-11-12-27-49(7)15-14-28(48(5,6)26(49)13-16-50(27,8)51(22,9)38(62)39(63)52(23,41)20-54)70-46-37(73-45-33(60)31(58)30(57)25(18-53)69-45)35(34(61)36(72-46)42(65)66)71-44-32(59)29(56)24(55)19-68-44/h10-11,23-41,44-46,53-64H,12-20H2,1-9H3,(H,65,66)/b21-10-/t23-,24+,25-,26-,27+,28-,29-,30-,31+,32+,33-,34-,35-,36-,37+,38-,39+,40-,41-,44-,45+,46+,49-,50+,51-,52-/m0/s1 |
InChIKey | LONAMHVSUGUOBB-MJSFBVFZSA-N |
Literature Reference Author | Z.ZHANG,S.LI,S.OWNBY,P.WANG,W.YUAN,W.ZHANG,R.S.BEASLEY |
Literature Reference Citation | PHYTOCHEM.,69,2070(2008) |
Literature Reference DOI | 10.1016/j.phytochem.2008.03.020 |
Molecular Weight | 1059.210 g/mol |
Sample ID | 63228 |
Solvent | C5D5N |