3-decan-2-yloxy-10-oxidanyl-9-(3-oxidanylidenebutyl)-4a,4b,5,6,7,8-hexahydro-4H-phenanthren-1-one

Systemtic Name: 3-decan-2-yloxy-10-oxidanyl-9-(3-oxidanylidenebutyl)-4a,4b,5,6,7,8-hexahydro-4H-phenanthren-1-one Openeye Name: 10-hydroxy-3-(1-methylnonoxy)-9-(3-oxobutyl)-4a,4b,5,6,7,8-hexahydro-4H-phenanthren-1-one CAS Name: 3-decan-2-yloxy-10-hydroxy-9-(3-oxobutyl)-4a,4b,5,6,7,8-hexahydro-4H-phenanthren-1-one IUPAC Name: 3-decan-2-yloxy-10-hydroxy-9-(3-oxobutyl)-4a,4b,5,6,7,8-hexahydro-4H-phenanthren-1-one Traditional Name: 10-hydroxy-9-(3-ketobutyl)-3-(1-methylnonoxy)-4a,4b,5,6,7,8-hexahydro-4H-phenanthren-1-one Formula: C28H42O4 MolecularWeight: 442.63068

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(C)OC1=CC(=O)C2=C(C(=C3CCCCC3C2C1)CCC(=O)C)O

Isomeric SMILES

CCCCCCCCC(C)OC1=CC(=O)C2=C(C(=C3CCCCC3C2C1)CCC(=O)C)O

InChI

InChI=1S/C28H42O4/c1-4-5-6-7-8-9-12-20(3)32-21-17-25-23-14-11-10-13-22(23)24(16-15-19(2)29)28(31)27(25)26(30)18-21/h18,20,23,25,31H,4-17H2,1-3H3