| SpectraBase Spectrum ID |
2Wr8jZOpZI9 |
| Name |
Rutin |
| Alternate Name(s) |
2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-((((2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)methyl)tetrahydro-2H-pyran-2-yl)oxy)-4H-chromen-4-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H30O16 |
| InChI |
InChI=1S/C27H30O16/c1-8-17(32)20(35)22(37)26(40-8)39-7-15-18(33)21(36)23(38)27(42-15)43-25-19(34)16-13(31)5-10(28)6-14(16)41-24(25)9-2-3-11(29)12(30)4-9/h2-6,8,15,17-18,20-23,26-33,35-38H,7H2,1H3/t8-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1 |
| InChIKey |
IKGXIBQEEMLURG-NVPNHPEKSA-N |
| Molecular Weight |
610.521 g/mol |
| SMILES |
Oc1cc(c2c(OC(=C(O[C@]3([C@@]([C@]([C@@]([C@@](CO[C@]4([C@@]([C@@]([C@]([C@@](O4)(C)[H])(O)[H])(O)[H])(O)[H])[H])(O3)[H])(O)[H])(O)[H])(O)[H])[H])C2=O)c2cc(O)c(cc2)O)c1)O |
| SPLASH |
splash10-0udi-0209000000-0aa15440d198ae52b482 |
| Source of Spectrum |
CBD-5-339-6 |
| Wiley ID |
1788632 |
