| 2D Structure | |
| CID | 3080635 |
| Target | / |
| IUPAC Name | (4aS,8aR)-3,8a-dimethyl-5-methylidene-4,4a,6,7,8,9-hexahydrobenzo[f][1]benzofuran |
| InChI | InChI=1S/C15H20O/c1-10-5-4-6-15(3)8-14-12(7-13(10)15)11(2)9-16-14/h9,13H,1,4-8H2,2-3H3/t13-,15+/m0/s1 |
| InChI Key | TYPSVDGIQAOBAD-DZGCQCFKSA-N |
| Canonical SMILES | CC1=COC2=C1CC3C(=C)CCCC3(C2)C |
| Isomeric SMILES | CC1=COC2=C1C[C@H]3C(=C)CCC[C@@]3(C2)C |
| Molecular Formula | C15H20O |
| Molecular Weight | 216.32 |
| synonyms | ['Atractylon', '6989-21-5', 'Atractylone', '(4aS,8aR)-3,8a-Dimethyl-5-methylene-4,4a,5,6,7,8,8a,9-octahydronaphtho[2,3-b]furan', 'Atractyloxide', '(4aS,8aR)-3,8a-dimethyl-5-methylidene-4,4a,6,7,8,9-hexahydrobenzo[f][1]benzofuran', 'DTXSID50220170', 'Naphtho[2,3-b]furan, 4,4a,5,6,7,8,8a,9-octahydro-3,8a-dimethyl-5-methylene-, (4aS,8aR)-', 'Naphtho(2,3-b)furan, 4,4a,5,6,7,8,8a,9-octahydro-3,8a-dimethyl-5-methylene-, (4aS-trans)-', '(4aR,8aS)-3,8a-dimethyl-5-methylidene-4,4a,6,7,8,9-hexahydrobenzo(f)(1)benzofuran', '(4aR,8aS)-3,8a-dimethyl-5-methylidene-4,4a,6,7,8,9-hexahydrobenzo[f][1]benzofuran', '(4aS,8aR)-3,8a-Dimethyl-5-methylene-4,4a,5,6,7,8,8a,9-octahydronaphtho(2,3-b)furan', '(4aS,8aR)-3,8a-dimethyl-5-methylidene-4,4a,6,7,8,9-hexahydrobenzo(f)(1)benzofuran', 'Naphtho(2,3-b)furan, 4,4a,5,6,7,8,8a,9-octahydro-3,8a-dimethyl-5-methylene-, (4aS,8aR)-', 'Naphtho[2,3-b]furan, 4,4a,5,6,7,8,8a,9-octahydro-3,8a-dimethyl-5-methylene-, (4aS-trans)-', 'DTXCID50142661', 'Naphtho[2,3-b]furan, 4,4a.alpha.,5,6,7,8,8a,9-octahydro-3,8a.beta.-dimethyl-5-methylene-', 'Naphtho(2,3-b)furan, 4,4aalpha,5,6,7,8,8a,9-octahydro-3,8abeta-dimethyl-5-methylene-', 'typsvdgiqaobad-uhfffaoysa-n', 'Atractyline(Discontinued)(Sh)', 'CHEMBL486189', 'CHEBI:80796', 'Atractylol', 'MFCD00210477', 'SCHEMBL19082783', 'GLXC-14731', 'HY-N2095', 'BDBM50241938', 's9158', 'AKOS016013441', 'CCG-266696', 'FS-7477', 'AC-34104', 'DA-61302', 'CS-0018600', 'C16919', 'Q27149840', '(4AS,8AR)-3,8A-DIMETHYL-5-METHYLIDENE-4H,4AH,5H,6H,7H,8H,8AH,9H-NAPHTHO[2,3-B]FURAN'] |
From Pubchem