(8Z,12S)-5-(methoxymethoxy)-5,9-dimethyl-10-oxidanyl-12-prop-1-en-2-yl-cyclotetradeca-1,2,8-trien-6-yne-1-carboxylic acid

Systemtic Name: (8Z,12S)-5-(methoxymethoxy)-5,9-dimethyl-10-oxidanyl-12-prop-1-en-2-yl-cyclotetradeca-1,2,8-trien-6-yne-1-carboxylic acid Openeye Name: (8Z,12S)-10-hydroxy-12-isopropenyl-5-(methoxymethoxy)-5,9-dimethyl-cyclotetradeca-1,2,8-trien-6-yne-1-carboxylic acid CAS Name: (8Z,12S)-10-hydroxy-5-(methoxymethoxy)-5,9-dimethyl-12-(1-methylethenyl)-1-cyclotetradeca-1,2,8-trien-6-ynecarboxylic acid IUPAC Name: (8Z,12S)-10-hydroxy-5-(methoxymethoxy)-5,9-dimethyl-12-prop-1-en-2-ylcyclotetradeca-1,2,8-trien-6-yne-1-carboxylic acid Traditional Name: (8Z,12S)-10-hydroxy-12-isopropenyl-5-(methoxymethoxy)-5,9-dimethyl-cyclotetradeca-1,2,8-trien-6-yne-1-carboxylic acid Formula: C22H30O5 MolecularWeight: 374.4706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC#CC(CC=C=C(CCC(CC1O)C(=C)C)C(=O)O)(C)OCOC

Isomeric SMILES

C/C/1=C/C#CC(CC=C=C(CC[C@@H](CC1O)C(=C)C)C(=O)O)(C)OCOC

InChI

InChI=1S/C22H30O5/c1-16(2)19-11-10-18(21(24)25)9-7-13-22(4,27-15-26-5)12-6-8-17(3)20(23)14-19/h7-8,19-20,23H,1,10-11,13-15H2,2-5H3,(H,24,25)/b17-8-/t9?,19-,20?,22?/m0/s1