![#3;1-(2,3,4-TRIHYDROXYPHENYL)-ETHYL-3-O-RHAMNOPYRANOSYL-4-[(2E)-3-(3,4-DIHYDROXYPHENYL)-2-PROPENOATE]-6-[(2E)-3-)3,4-DIHYDROXYPHENYL)-2-PROPENOATE]-GLUCOPYRANO](/api/spectrum/8aMUwYh526z/structure.png?h=300&w=458 "#3;1-(2,3,4-TRIHYDROXYPHENYL)-ETHYL-3-O-RHAMNOPYRANOSYL-4-[(2E)-3-(3,4-DIHYDROXYPHENYL)-2-PROPENOATE]-6-[(2E)-3-)3,4-DIHYDROXYPHENYL)-2-PROPENOATE]-GLUCOPYRANO")
| SpectraBase Compound ID | 8toBi72ToAp |
|---|---|
| InChI | InChI=1S/C38H42O18/c1-18-31(47)32(48)33(49)38(53-18)56-36-34(50)37(51-13-12-21-4-9-24(41)27(44)16-21)54-28(17-52-29(45)10-5-19-2-7-22(39)25(42)14-19)35(36)55-30(46)11-6-20-3-8-23(40)26(43)15-20/h2-11,14-16,18,28,31-44,47-50H,12-13,17H2,1H3/b10-5+,11-6+/t18-,28-,31-,32+,33+,34-,35-,36-,37-,38-/m0/s1 |
| InChIKey | RYLPFCXBODDDGD-ZSKFSCKUSA-N |
| Mol Weight | 786.7 g/mol |
| Molecular Formula | C38H42O18 |
| Exact Mass | 786.237114 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8aMUwYh526z |
|---|---|
| Name | #3;1-(2,3,4-TRIHYDROXYPHENYL)-ETHYL-3-O-RHAMNOPYRANOSYL-4-[(2E)-3-(3,4-DIHYDROXYPHENYL)-2-PROPENOATE]-6-[(2E)-3-)3,4-DIHYDROXYPHENYL)-2-PROPENOATE]-GLUCOPYRANO |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C38H42O18 |
| InChI | InChI=1S/C38H42O18/c1-18-31(47)32(48)33(49)38(53-18)56-36-34(50)37(51-13-12-21-4-9-24(41)27(44)16-21)54-28(17-52-29(45)10-5-19-2-7-22(39)25(42)14-19)35(36)55-30(46)11-6-20-3-8-23(40)26(43)15-20/h2-11,14-16,18,28,31-44,47-50H,12-13,17H2,1H3/b10-5+,11-6+/t18-,28-,31-,32+,33+,34-,35-,36-,37-,38-/m0/s1 |
| InChIKey | RYLPFCXBODDDGD-ZSKFSCKUSA-N |
| Literature Reference Author | B.B.ZHANG,K.SHI,Z.X.LIAO,Y.DAI,Z.H.ZOU |
| Literature Reference Citation | FITOTERAPIA,82,854(2011) |
| Literature Reference DOI | 10.1016/j.fitote.2011.04.005 |
| Molecular Weight | 786.741 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWDB1052 |