2-(hydroxymethyl)-3,13-dimethyl-16-oxidanyl-3,13-diphenyl-hexadec-1-en-8-one

Systemtic Name: 2-(hydroxymethyl)-3,13-dimethyl-16-oxidanyl-3,13-diphenyl-hexadec-1-en-8-one Openeye Name: 16-hydroxy-2-(hydroxymethyl)-3,13-dimethyl-3,13-diphenyl-hexadec-1-en-8-one CAS Name: 16-hydroxy-2-(hydroxymethyl)-3,13-dimethyl-3,13-diphenyl-1-hexadecen-8-one IUPAC Name: 16-hydroxy-2-(hydroxymethyl)-3,13-dimethyl-3,13-diphenylhexadec-1-en-8-one Traditional Name: 16-hydroxy-3,13-dimethyl-2-methylol-3,13-diphenyl-hexadec-1-en-8-one Formula: C31H44O3 MolecularWeight: 464.67926

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCC(=O)CCCCC(C)(C1=CC=CC=C1)C(=C)CO)(CCCO)C2=CC=CC=C2

Isomeric SMILES

CC(CCCCC(=O)CCCCC(C)(C1=CC=CC=C1)C(=C)CO)(CCCO)C2=CC=CC=C2

InChI

InChI=1S/C31H44O3/c1-26(25-33)31(3,28-17-8-5-9-18-28)23-13-11-20-29(34)19-10-12-21-30(2,22-14-24-32)27-15-6-4-7-16-27/h4-9,15-18,32-33H,1,10-14,19-25H2,2-3H3