| 2D Structure | |
| CID | 23626637 |
| Target | / |
| IUPAC Name | (1S,2S,3R,4R,7S,8R,10S,12S,13R,14R,15S,17R,19S,20R)-15-(furan-3-yl)-3,4,8,13,20-pentahydroxy-2,7,14,20-tetramethyl-6,11,18-trioxahexacyclo[10.8.0.02,10.03,7.014,19.017,19]icosan-5-one |
| InChI | InChI=1S/C25H32O10/c1-20-11(10-5-6-32-9-10)7-14-25(20,34-14)22(3,30)16-15(17(20)27)33-13-8-12(26)23(4)24(31,21(13,16)2)18(28)19(29)35-23/h5-6,9,11-18,26-28,30-31H,7-8H2,1-4H3/t11-,12+,13-,14+,15-,16+,17-,18-,20+,21+,22+,23-,24-,25+/m0/s1 |
| InChI Key | HRTHMOOARAGYNK-YIROTGMCSA-N |
| Canonical SMILES | CC12C(CC3C1(O3)C(C4C(C2O)OC5C4(C6(C(C(=O)OC6(C(C5)O)C)O)O)C)(C)O)C7=COC=C7 |
| Isomeric SMILES | C[C@]12[C@@H](C[C@@H]3[C@]1(O3)[C@]([C@@H]4[C@@H]([C@@H]2O)O[C@@H]5[C@]4([C@]6([C@H](C(=O)O[C@]6([C@@H](C5)O)C)O)O)C)(C)O)C7=COC=C7 |
| Molecular Formula | C25H32O10 |
| Molecular Weight | 492.5 |
| synonyms | ['Toonaciliatin F', '(1S,2S,3R,4R,7S,8R,10S,12S,13R,14R,15S,17R,19S,20R)-15-(Furan-3-yl)-3,4,8,13,20-pentahydroxy-2,7,14,20-tetramethyl-6,11,18-trioxahexacyclo[10.8.0.02,10.03,7.014,19.017,19]icosan-5-one'] |
From Pubchem