5-[2-tert-butyl-4-(hydroxymethyl)-5-methyl-phenyl]sulfanyl-2-[2-(3-methyl-4-oxidanyl-phenyl)ethyl]-6-oxidanyl-2-propan-2-yl-3H-pyran-4-one

Systemtic Name: 5-[2-tert-butyl-4-(hydroxymethyl)-5-methyl-phenyl]sulfanyl-2-[2-(3-methyl-4-oxidanyl-phenyl)ethyl]-6-oxidanyl-2-propan-2-yl-3H-pyran-4-one Openeye Name: 5-[2-tert-butyl-4-(hydroxymethyl)-5-methyl-phenyl]sulfanyl-6-hydroxy-2-[2-(4-hydroxy-3-methyl-phenyl)ethyl]-2-isopropyl-3H-pyran-4-one CAS Name: 5-[[2-tert-butyl-4-(hydroxymethyl)-5-methylphenyl]thio]-6-hydroxy-2-[2-(4-hydroxy-3-methylphenyl)ethyl]-2-propan-2-yl-3H-pyran-4-one IUPAC Name: 5-[2-tert-butyl-4-(hydroxymethyl)-5-methylphenyl]sulfanyl-6-hydroxy-2-[2-(4-hydroxy-3-methylphenyl)ethyl]-2-propan-2-yl-3H-pyran-4-one Traditional Name: 5-[(2-tert-butyl-5-methyl-4-methylol-phenyl)thio]-6-hydroxy-2-[2-(4-hydroxy-3-methyl-phenyl)ethyl]-2-isopropyl-3H-pyran-4-one Formula: C29H38O5S MolecularWeight: 498.67402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1CO)C(C)(C)C)SC2=C(OC(CC2=O)(CCC3=CC(=C(C=C3)O)C)C(C)C)O

Isomeric SMILES

CC1=CC(=C(C=C1CO)C(C)(C)C)SC2=C(OC(CC2=O)(CCC3=CC(=C(C=C3)O)C)C(C)C)O

InChI

InChI=1S/C29H38O5S/c1-17(2)29(11-10-20-8-9-23(31)19(4)12-20)15-24(32)26(27(33)34-29)35-25-13-18(3)21(16-30)14-22(25)28(5,6)7/h8-9,12-14,17,30-31,33H,10-11,15-16H2,1-7H3