| SpectraBase Compound ID | OjtxiC2Oa4 |
|---|---|
| InChI | InChI=1S/C42H46O22/c1-16-28(48)34(54)39(64-41-36(56)32(52)29(49)24(14-43)61-41)42(58-16)63-38-31(51)27-22(46)12-21(13-23(27)60-37(38)18-5-9-20(45)10-6-18)59-40-35(55)33(53)30(50)25(62-40)15-57-26(47)11-4-17-2-7-19(44)8-3-17/h2-13,16,24-25,28-30,32-36,39-46,48-50,52-56H,14-15H2,1H3/b11-4+/t16-,24+,25-,28-,29+,30-,32-,33+,34+,35-,36+,39+,40-,41-,42-/m1/s1 |
| InChIKey | COFIEYUEZUDPJJ-OCMZNHSHSA-N |
| Mol Weight | 902.8 g/mol |
| Molecular Formula | C42H46O22 |
| Exact Mass | 902.248073 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5yqqmpXXB7w |
|---|---|
| Name | KAEMPFEROL-3-O-BETA-D-GLUCOPYRANOSYL-(1'''->2'')-O-ALPHA-L-RHAMNOPYRANOSIDE-7-O-BETA-D-(6'''-O-E-COUMARYL-GLUCOPYRANOSIDE) |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C42H46O22 |
| InChI | InChI=1S/C42H46O22/c1-16-28(48)34(54)39(64-41-36(56)32(52)29(49)24(14-43)61-41)42(58-16)63-38-31(51)27-22(46)12-21(13-23(27)60-37(38)18-5-9-20(45)10-6-18)59-40-35(55)33(53)30(50)25(62-40)15-57-26(47)11-4-17-2-7-19(44)8-3-17/h2-13,16,24-25,28-30,32-36,39-46,48-50,52-56H,14-15H2,1H3/b11-4+/t16-,24+,25-,28-,29+,30-,32-,33+,34+,35-,36+,39+,40-,41-,42-/m1/s1 |
| InChIKey | COFIEYUEZUDPJJ-OCMZNHSHSA-N |
| Literature Reference Author | N.H.EL-SAYED,N.M.OMARA,A.K.YOUSEF,A.M.FARAG,T.J.MABRY |
| Literature Reference Citation | PHYTOCHEM.,57,575(2001) |
| Literature Reference DOI | 10.1016/S0031-9422(00)00479-9 |
| Molecular Weight | 902.814 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWVN2299 |