Details of PASSICOCCIN
| IUPAC | [4-cyano-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxycyclopent-2-en-1-yl] hydrogen sulfate |
| Canonical Smiles | CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3(CC(C=C3)OS(=O)(=O)O)C#N)O)O)O)O)O)O |
| Inchi | AFTIHDWVYIIJKS-GGJZXZOSSA-N |
| PubChem ID | 188631 |
| Smiles | CC1OC(OCC2OC(OC3(C#N)C=CC(OS(=O)(=O)O)C3)C(O)C(O)C2O)C(O)C(O)C1O |
ERROR opening https://cactus.nci.nih.gov/chemical/structure/CC1OC%28OCC2OC%28OC3%28C/file?format=sdf&get3d=True -- CC1OC%28OCC2OC%28OC3%28C could not be loaded.
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