![ESCULENTOSIDE-R;#7;3-O-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)-BETA-D-GLUCOPYRANOSYL-(1->2)-BETA-D-XYLOPYRANOSYL]-28-O-BETA-D-GLUCOPYRANOSYL-PHYTOLACCAGENIC-ACID](/api/spectrum/H5010h8jAwL/structure.png?h=300&w=458 "ESCULENTOSIDE-R;#7;3-O-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)-BETA-D-GLUCOPYRANOSYL-(1->2)-BETA-D-XYLOPYRANOSYL]-28-O-BETA-D-GLUCOPYRANOSYL-PHYTOLACCAGENIC-ACID")
| SpectraBase Compound ID | DYmLWX7YSHw |
|---|---|
| InChI | InChI=1S/C54H86O24/c1-23-32(59)36(63)39(66)43(72-23)76-42-38(65)35(62)28(20-56)74-46(42)77-41-33(60)26(58)21-71-45(41)75-31-11-12-50(3)29(51(31,4)22-57)10-13-53(6)30(50)9-8-24-25-18-49(2,47(68)70-7)14-16-54(25,17-15-52(24,53)5)48(69)78-44-40(67)37(64)34(61)27(19-55)73-44/h8,23,25-46,55-67H,9-22H2,1-7H3/t23-,25-,26+,27+,28+,29+,30+,31-,32-,33-,34+,35+,36+,37-,38-,39+,40+,41-,42+,43-,44-,45-,46-,49-,50-,51-,52+,53+,54-/m0/s1 |
| InChIKey | GAAOCKGKSCTHHU-VUQJTGFXSA-N |
| Mol Weight | 1119.3 g/mol |
| Molecular Formula | C54H86O24 |
| Exact Mass | 1118.550904 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | H5010h8jAwL |
|---|---|
| Name | ESCULENTOSIDE-R;#7;3-O-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)-BETA-D-GLUCOPYRANOSYL-(1->2)-BETA-D-XYLOPYRANOSYL]-28-O-BETA-D-GLUCOPYRANOSYL-PHYTOLACCAGENIC-ACID |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C54H86O24 |
| InChI | InChI=1S/C54H86O24/c1-23-32(59)36(63)39(66)43(72-23)76-42-38(65)35(62)28(20-56)74-46(42)77-41-33(60)26(58)21-71-45(41)75-31-11-12-50(3)29(51(31,4)22-57)10-13-53(6)30(50)9-8-24-25-18-49(2,47(68)70-7)14-16-54(25,17-15-52(24,53)5)48(69)78-44-40(67)37(64)34(61)27(19-55)73-44/h8,23,25-46,55-67H,9-22H2,1-7H3/t23-,25-,26+,27+,28+,29+,30+,31-,32-,33-,34+,35+,36+,37-,38-,39+,40+,41-,42+,43-,44-,45-,46-,49-,50-,51-,52+,53+,54-/m0/s1 |
| InChIKey | GAAOCKGKSCTHHU-VUQJTGFXSA-N |
| Literature Reference Author | A.STRAUSS,S.M.SPENGEL,W.SCHAFFNER |
| Literature Reference Citation | PHYTOCHEM.,38,861(1995) |
| Literature Reference DOI | 10.1016/0031-9422(94)00749-J |
| Molecular Weight | 1119.262 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMS3745 |