Description
IUPAC Name: [(3aR,4R,6R,7Z,10Z,11aR)-6-hydroxy-6,10-dimethyl-3-methylidene-2,9-dioxo-3a,4,5,11a-tetrahydrocyclodeca[b]furan-4-yl] 2-methylpropanoate
InChI: InChI=1S/C19H24O6/c1-10(2)17(21)25-15-9-19(5,23)7-6-13(20)11(3)8-14-16(15)12(4)18(22)24-14/h6-8,10,14-16,23H,4,9H2,1-3,5H3/b7-6-,11-8-/t14-,15-,16+,19+/m1/s1
InChIKey: DUQSSEQKLJQACA-XVBXXOAXSA-N
Canonical SMILES: CC1=CC2C(C(CC(C=CC1=O)(C)O)OC(=O)C(C)C)C(=C)C(=O)O2
Isomeric SMILES: C/C/1=C/[C@@H]2[C@@H]([C@@H](C[C@@](/C=CC1=O)(C)O)OC(=O)C(C)C)C(=C)C(=O)O2
Synonyms: Tagitinim C; tagitinin C; 59979-56-5; Propanoic acid, 2-methyl-, 2,3,3a,4,5,6,9,11a-octahydro-6-hydroxy-6,10-dimethyl-3-methylene-2,9-dioxocyclodeca(b)furan-4-yl ester, (3aR-(3aR*,4R*,6R*,7E,10Z,11aR*))-; [(3aR,4R,6R,7Z,10Z,11aR)-6-hydroxy-6,10-dimethyl-3-methylidene-2,9-dioxo-3a,4,5,11a-tetrahydrocyclodeca[b]furan-4-yl] 2-methylpropanoate; (4R,6R,7E,10Z)-2,3,3abeta,4,5,6,9,11aalpha-Octahydro-3-methylene-6-hydroxy-2,9-dioxo-4-(2-methylpropanoyloxy)-6,10-dimethylcyclodeca[b]furan; HY-N12535; CS-0928524
Botanical Source: