| SpectraBase Compound ID | 54H9PX0Mlii |
|---|---|
| InChI | InChI=1S/C30H30O12/c31-18-7-1-16(2-8-18)5-11-21(33)26-22(34)13-20(14-23(26)35)41-30-29(39)28(38)27(37)24(42-30)15-40-25(36)12-6-17-3-9-19(32)10-4-17/h1-4,6-10,12-14,24,27-32,34-35,37-39H,5,11,15H2/b12-6+/t24-,27-,28+,29-,30-/m0/s1 |
| InChIKey | HWXXMGOMTMMYFC-OPMNIJDYSA-N |
| Mol Weight | 582.56 g/mol |
| Molecular Formula | C30H30O12 |
| Exact Mass | 582.173726 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 236B4jb6tFz |
|---|---|
| Name | 6''-O-COUMAROYL-4'-O-GLUCOPYRANOSYL-PHLORETIN |
| Compound Number | A6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H30O12 |
| InChI | InChI=1S/C30H30O12/c31-18-7-1-16(2-8-18)5-11-21(33)26-22(34)13-20(14-23(26)35)41-30-29(39)28(38)27(37)24(42-30)15-40-25(36)12-6-17-3-9-19(32)10-4-17/h1-4,6-10,12-14,24,27-32,34-35,37-39H,5,11,15H2/b12-6+/t24-,27-,28+,29-,30-/m0/s1 |
| InChIKey | HWXXMGOMTMMYFC-OPMNIJDYSA-N |
| Literature Reference Author | X.QIN,Y.F.XING,Z.ZHOU,Y.YAO |
| Literature Reference Citation | MOLECULES,20,21193(2015) |
| Literature Reference DOI | 10.3390/molecules201219754 |
| Molecular Weight | 582.561 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWPA7007 |