![#9;ERYNGIOSIDE-F;22-ALPHA-ANGELOYLOXY-3-BETA-[BETA-D-GLUCOPYRANOSYL-(1->2)]-[BETA-D-XYLOPYRANOSYL-(1->3)]-BETA-D-GLUCORONOPYRANOSYLOXY-OLEAN-12-ENE-16-ALPHA,21](/api/spectrum/8XbLHBU8AbD/structure.png?h=300&w=458 "#9;ERYNGIOSIDE-F;22-ALPHA-ANGELOYLOXY-3-BETA-[BETA-D-GLUCOPYRANOSYL-(1->2)]-[BETA-D-XYLOPYRANOSYL-(1->3)]-BETA-D-GLUCORONOPYRANOSYLOXY-OLEAN-12-ENE-16-ALPHA,21")
| SpectraBase Compound ID | 94nWeTAHlzg |
|---|---|
| InChI | InChI=1S/C52H82O21/c1-10-22(2)43(66)73-41-40(63)47(3,4)17-24-23-11-12-28-49(7)15-14-30(48(5,6)27(49)13-16-50(28,8)51(23,9)18-29(56)52(24,41)21-54)69-46-39(72-45-35(61)33(59)32(58)26(19-53)68-45)37(36(62)38(71-46)42(64)65)70-44-34(60)31(57)25(55)20-67-44/h10-11,24-41,44-46,53-63H,12-21H2,1-9H3,(H,64,65)/b22-10-/t24-,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 | OMZNKQCPCUOTLS-DOSSLPFBSA-N |
| Mol Weight | 1043.2 g/mol |
| Molecular Formula | C52H82O21 |
| Exact Mass | 1042.53486 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8XbLHBU8AbD |
|---|---|
| Name | #9;ERYNGIOSIDE-F;22-ALPHA-ANGELOYLOXY-3-BETA-[BETA-D-GLUCOPYRANOSYL-(1->2)]-[BETA-D-XYLOPYRANOSYL-(1->3)]-BETA-D-GLUCORONOPYRANOSYLOXY-OLEAN-12-ENE-16-ALPHA,21 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C52H82O21 |
| InChI | InChI=1S/C52H82O21/c1-10-22(2)43(66)73-41-40(63)47(3,4)17-24-23-11-12-28-49(7)15-14-30(48(5,6)27(49)13-16-50(28,8)51(23,9)18-29(56)52(24,41)21-54)69-46-39(72-45-35(61)33(59)32(58)26(19-53)68-45)37(36(62)38(71-46)42(64)65)70-44-34(60)31(57)25(55)20-67-44/h10-11,24-41,44-46,53-63H,12-21H2,1-9H3,(H,64,65)/b22-10-/t24-,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 | OMZNKQCPCUOTLS-DOSSLPFBSA-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 | 1043.210 g/mol |
| Sample ID | 63229 |
| Solvent | C5D5N |