(2R,12S,13S)-2,13-dimethyl-12-propan-2-yl-4,11-dioxabicyclo[12.2.2]octadeca-1(16),14,17-triene-5,10-dione

Systemtic Name: (2R,12S,13S)-2,13-dimethyl-12-propan-2-yl-4,11-dioxabicyclo[12.2.2]octadeca-1(16),14,17-triene-5,10-dione Openeye Name: (2R,12S,13S)-12-isopropyl-2,13-dimethyl-4,11-dioxabicyclo[12.2.2]octadeca-1(16),14,17-triene-5,10-dione CAS Name: (2R,12S,13S)-2,13-dimethyl-12-propan-2-yl-4,11-dioxabicyclo[12.2.2]octadeca-1(16),14,17-triene-5,10-dione IUPAC Name: (2R,12S,13S)-2,13-dimethyl-12-propan-2-yl-4,11-dioxabicyclo[12.2.2]octadeca-1(16),14,17-triene-5,10-dione Traditional Name: (2R,12S,13S)-12-isopropyl-2,13-dimethyl-4,11-dioxabicyclo[12.2.2]octadeca-1(16),14,17-triene-5,10-quinone Formula: C21H30O4 MolecularWeight: 346.4605

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1COC(=O)CCCCC(=O)OC(C(C2=CC=C1C=C2)C)C(C)C

Isomeric SMILES

C[C@H]1COC(=O)CCCCC(=O)O[C@H]([C@H](C2=CC=C1C=C2)C)C(C)C

InChI

InChI=1S/C21H30O4/c1-14(2)21-16(4)18-11-9-17(10-12-18)15(3)13-24-19(22)7-5-6-8-20(23)25-21/h9-12,14-16,21H,5-8,13H2,1-4H3/t15-,16-,21-/m0/s1