Details of Nandinin
| IUPAC | [(2R,3S,4R,5R,6S)-6-[4-[cyano(hydroxy)methyl]phenoxy]-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate |
| Canonical Smiles | C1=CC(=CC=C1C(C#N)O)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)OC(=O)/C=C/C3=CC(=C(C=C3)O)O)O)O |
| Inchi | OTBWOFBYEYFNNC-YDWCALSJSA-N |
| PubChem ID | 6442984 |
| Smiles | N#CC(O)c1ccc(O[C@@H]2O[C@H](CO)[C@@H](OC(=O)C=Cc3ccc(O)c(O)c3)[C@H](O)[C@H]2O)cc1 |
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