(9E)-12-ethyl-3,5,7,11-tetramethyl-11-oxidanyl-6-(3-oxidanyloxan-2-yl)oxy-1-oxacyclododec-9-ene-2,8-dione

Systemtic Name: (9E)-12-ethyl-3,5,7,11-tetramethyl-11-oxidanyl-6-(3-oxidanyloxan-2-yl)oxy-1-oxacyclododec-9-ene-2,8-dione Openeye Name: (9E)-12-ethyl-11-hydroxy-6-(3-hydroxytetrahydropyran-2-yl)oxy-3,5,7,11-tetramethyl-1-oxacyclododec-9-ene-2,8-dione CAS Name: (9E)-12-ethyl-11-hydroxy-6-[(3-hydroxy-2-oxanyl)oxy]-3,5,7,11-tetramethyl-1-oxacyclododec-9-ene-2,8-dione IUPAC Name: (9E)-12-ethyl-11-hydroxy-6-(3-hydroxyoxan-2-yl)oxy-3,5,7,11-tetramethyl-1-oxacyclododec-9-ene-2,8-dione Traditional Name: (9E)-12-ethyl-11-hydroxy-6-(3-hydroxytetrahydropyran-2-yl)oxy-3,5,7,11-tetramethyl-1-oxacyclododec-9-ene-2,8-quinone Formula: C22H36O7 MolecularWeight: 412.51704

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(C=CC(=O)C(C(C(CC(C(=O)O1)C)C)OC2C(CCCO2)O)C)(C)O

Isomeric SMILES

CCC1C(/C=C/C(=O)C(C(C(CC(C(=O)O1)C)C)OC2C(CCCO2)O)C)(C)O

InChI

InChI=1S/C22H36O7/c1-6-18-22(5,26)10-9-16(23)15(4)19(13(2)12-14(3)20(25)28-18)29-21-17(24)8-7-11-27-21/h9-10,13-15,17-19,21,24,26H,6-8,11-12H2,1-5H3/b10-9+