Sesamin

2D Structure
CID 72307
Target CYP2C9 , TARDBP
IUPAC Name 5-[(3S,3aR,6S,6aR)-3-(1,3-benzodioxol-5-yl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-6-yl]-1,3-benzodioxole
InChI InChI=1S/C20H18O6/c1-3-15-17(25-9-23-15)5-11(1)19-13-7-22-20(14(13)8-21-19)12-2-4-16-18(6-12)26-10-24-16/h1-6,13-14,19-20H,7-10H2/t13-,14-,19+,20+/m0/s1
InChI Key PEYUIKBAABKQKQ-AFHBHXEDSA-N
Canonical SMILES C1C2C(COC2C3=CC4=C(C=C3)OCO4)C(O1)C5=CC6=C(C=C5)OCO6
Isomeric SMILES C1[C@H]2[C@H](CO[C@@H]2C3=CC4=C(C=C3)OCO4)[C@H](O1)C5=CC6=C(C=C5)OCO6
Molecular Formula C20H18O6
Molecular Weight 354.4
synonyms ['sesamin', '607-80-7', 'Fagarol', 'Sezamin', '(+)-Sesamin', 'D-(+)-Sesamin', 'd-Sesamin', 'CHEBI:66470', 'NSC 36403', 'UNII-S7946O4P76', 'AI3-00811', 'S7946O4P76', 'NSC-36403', '1H,3H-Furo(3,4-c)furan, tetrahydro-1,4-bis(3,4-(methylenedioxy)phenyl)-, (1S,3aR,4S,6aR)-', 'Sesamin, (+)-', "1,3-Benzodioxole, 5,5'-(tetrahydro-1H,3H-furo(3,4-c)furan-1,4-diyl)bis-, (1S-(1alpha,3a alpha,4alpha,6a alpha))-", "5,5'-(TETRAHYDRO-1H,3H-FURO(3,4-C)FURAN-1,4-DIYL)BIS-1,3-BENZODIOXOLE", 'TETRAHYDRO-1,4-BIS(3,4-(METHYLENEDIOXY)PHENYL)-1H,3H-FURO(3,4-C)FURAN', "5,5'-(1S,3aR,4S,6aR)-tetrahydro-1H,3H-furo(3,4-c)furan-1,4-diylbis(1,3-benzodioxole)", "5,5'-(1S,3aR,4S,6aR)-tetrahydro-1H,3H-furo[3,4-c]furan-1,4-diylbis(1,3-benzodioxole)", 'SESAMIN D-FORM', 'Asarinin', 'Episesamin', '(+/-)-Sesamin', 'Sesamin dl-form [MI]', 'Sesamin, (+/-)-', '(+)-Segamin', 'FY3S29JVC9', '5-[(3S,3aR,6S,6aR)-3-(1,3-benzodioxol-5-yl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-6-yl]-1,3-benzodioxole', '81602-22-4', 'MFCD00216134', 'PSEUDO CUBEBIN', 'pseudocubebin', "1,3-Benzodioxole, 5,5'-((1R,3as,4R,6as)-tetrahydro-1H,3h-furo(3,4-c)furan-1,4-diyl)bis-, rel-", 'l-sesamin', '(1S,3aR,4S,6aR)-1,4-Bis(benzo[d][1,3]dioxol-5-yl)hexahydrofuro[3,4-c]furan', 'SMR000445559', 'SR-01000777562', 'UNII-FY3S29JVC9', 'Sesamin (Fagarol)', '5-[(3S,3aR,6S,6aR)-6-(1,3-benzodioxol-5-yl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-3-yl]-1,3-benzodioxole', "Rel-(7S,7'S8R,8'R)-Sesamin", 'Sesamin (Standard)', 'SESAMIN [MI]', 'SESAMIN [WHO-DD]', 'Sesamin, analytical standard', 'SCHEMBL94517', 'SESAMIN D-FORM [MI]', 'MLS000728578', 'MLS002473316', 'CHEMBL252915', 'Sesamin, >=95%, crystalline', 'Sesamin, >=98% (HPLC)', 'ACon0_000323', 'ACon1_002421', 'GTPL11372', 'HY-N0121R', 'MSK5401', 'PEYUIKBAABKQKQ-AFHBHXEDSA-N', 'DTXSID301030528', 'HMS2232F11', 'HY-N0121', 'BDBM50542904', 's2392', 'AKOS022168195', 'CCG-268081', 'FS27823', '(1S,3aR,4S,6aR)-1,4-bis(benzo[d][1,3]dioxol-5-yl)tetrahydro-1H,3H-furo[3,4-c]furan', 'NCGC00169864-01', 'NCGC00169864-02', "1,3-Benzodioxole, 5,5'-(tetrahydro-1H,3h-furo(3,4-c)furan-1,4-diyl)bis-, (1alpha,3aalpha,4alpha,6aalpha)-", "1,3-Benzodioxole, 5,5'-(tetrahydro-1H,3h-furo(3,4-c)furan-1,4-diyl)bis-, (1alpha,3aalpha,4alpha,6aalpha)-(+/-)-", "1,3-Benzodioxole, 5,5'-(tetrahydro-1H,3H-furo[3,4-c]furan-1,4-diyl)bis-, (1S,3aR,4S,6aR)-", 'AS-13527', "REL-(7S,7'S,8R,8'R)-SESAMIN", 'CS-0007831', 'NS00096653', 'M06046', 'SesaminSezamin; (+)-Sesamin; D-(+)-Sesamin', 'A832882', 'Q3511416', 'SR-01000777562-3', 'SR-01000777562-4', 'BRD-K11631773-001-10-8', "5,5'-(1S,3aR,4S,6aR)-Tetrahydro-1H,3H-furo[3,4-c]furan-1,4-diylbis(1,3-benzodioxol)", "(1S,3aR,4S,6aR)-5,5'-(Tetrahydro-1H,3H-furo[3,4-c]furan-1,4-diyl)bis-1,3-benzodioxole;(+)-Sesamin;Fagarol", "1,3-BENZODIOXOLE, 5,5'-(TETRAHYDRO-1H,3H-FURO(3,4-C)FURAN-1,4-DIYL)BIS-, (1.ALPHA.,3A.ALPHA.,4.ALPHA.,6A.ALPHA.)-", "1,3-BENZODIOXOLE, 5,5'-(TETRAHYDRO-1H,3H-FURO(3,4-C)FURAN-1,4-DIYL)BIS-, (1.ALPHA.,3A.ALPHA.,4.ALPHA.,6A.ALPHA.)-(+/-)-", "1,3-BENZODIOXOLE, 5,5'-(TETRAHYDRO-1H,3H-FURO(3,4-C)FURAN-1,4-DIYL)BIS-, (1S-(1.ALPHA.,3A .ALPHA.,4.ALPHA.,6A .ALPHA.))-"]

From Pubchem