| SpectraBase Compound ID | 1kqa3L4whr2 |
|---|---|
| InChI | InChI=1S/C27H34O14/c1-11-20(32)22(34)24(36)26(39-11)38-10-18-21(33)23(35)25(37)27(41-18)40-17-9-14(29)8-16(31)19(17)15(30)7-4-12-2-5-13(28)6-3-12/h2-3,5-6,8-9,11,18,20-29,31-37H,4,7,10H2,1H3/t11-,18+,20-,21+,22+,23-,24+,25+,26+,27+/m0/s1 |
| InChIKey | ADFPWLIPMJWMOS-FMRDSFNFSA-N |
| Mol Weight | 582.6 g/mol |
| Molecular Formula | C27H34O14 |
| Exact Mass | 582.194856 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8SQHVESajKx |
|---|---|
| Name | PHLORETIN-RUTINOSIDE |
| Compound Number | A4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H34O14 |
| InChI | InChI=1S/C27H34O14/c1-11-20(32)22(34)24(36)26(39-11)38-10-18-21(33)23(35)25(37)27(41-18)40-17-9-14(29)8-16(31)19(17)15(30)7-4-12-2-5-13(28)6-3-12/h2-3,5-6,8-9,11,18,20-29,31-37H,4,7,10H2,1H3/t11-,18+,20-,21+,22+,23-,24+,25+,26+,27+/m0/s1 |
| InChIKey | ADFPWLIPMJWMOS-FMRDSFNFSA-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 | 582.559 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWPA7005 |