Details of Isocelosianin I
| IUPAC | (2S)-4-[(E)-2-[(2R)-2-carboxy-5-[(2S,3R,4S,5S,6R)-3-[(2R,3R,4S,5S,6S)-6-carboxy-4,5-dihydroxy-3-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxyoxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-hydroxy-2,3-dihydroindol-1-yl]ethenyl]-2,3-dihydropyridine-2,6-dicarboxylic acid |
| Canonical Smiles | C1C(N=C(C=C1C=CN2C(CC3=CC(=C(C=C32)O)OC4C(C(C(C(O4)CO)O)O)OC5C(C(C(C(O5)C(=O)O)O)O)OC(=O)C=CC6=CC=C(C=C6)O)C(=O)O)C(=O)O)C(=O)O |
| Inchi | RONAYNDJLUCGBS-WKSMSGBBSA-N |
| PubChem ID | 101105493 |
| Smiles | O=C(C=Cc1ccc(O)cc1)OC1C(OC2C(Oc3cc4c(cc3O)N(C=Cc3cc(C(=O)O)nc(C(O)O)c3)C(C(=O)O)C4)OC(CO)C(O)C2O)OC(C(=O)O)C(O)C1O |
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| Super Class | |
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