Details of Jacein
| IUPAC | 5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-3,6-dimethoxy-7-[(2S,4S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one |
| Canonical Smiles | COC1=C(C=CC(=C1)C2=C(C(=O)C3=C(C(=C(C=C3O2)O[C@H]4C([C@H]([C@@H](C(O4)CO)O)O)O)OC)O)OC)O |
| Inchi | NYTZRFVFIRTFIX-NIZXRZDQSA-N |
| PubChem ID | 44259819 |
| Smiles | COc1cc(-c2oc3cc(O[C@@H]4OC(CO)[C@@H](O)[C@H](O)C4O)c(OC)c(O)c3c(=O)c2OC)ccc1O |
ERROR opening https://cactus.nci.nih.gov/chemical/structure/COc1cc%28-c2oc3cc%28O%5BC%40%40H%5D4OC%28CO%29%5BC%40%40H%5D%28O%29%5BC%40H%5D%28O%29C4O%29c%28OC%29c%28O%29c3c%28%3DO%29c2OC%29ccc1O/file?format=sdf&get3d=True -- COc1cc%28-c2oc3cc%28O%5BC%40%40H%5D4OC%28CO%29%5BC%40%40H%5D%28O%29%5BC%40H%5D%28O%29C4O%29c%28OC%29c%28O%29c3c%28%3DO%29c2OC%29ccc1O could not be loaded.
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