11-(4-tert-butylphenyl)-17-hex-1-ynyl-13-methyl-16,17-bis(oxidanyl)-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one

Systemtic Name: 11-(4-tert-butylphenyl)-17-hex-1-ynyl-13-methyl-16,17-bis(oxidanyl)-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one Openeye Name: 11-(4-tert-butylphenyl)-17-hex-1-ynyl-16,17-dihydroxy-13-methyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one CAS Name: 11-(4-tert-butylphenyl)-17-hex-1-ynyl-16,17-dihydroxy-13-methyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one IUPAC Name: 11-(4-tert-butylphenyl)-17-hex-1-ynyl-16,17-dihydroxy-13-methyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one Traditional Name: 11-(4-tert-butylphenyl)-17-hex-1-ynyl-16,17-dihydroxy-13-methyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one Formula: C34H44O3 MolecularWeight: 500.71136

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC1(C(CC2C1(CC(C3=C4CCC(=O)C=C4CCC23)C5=CC=C(C=C5)C(C)(C)C)C)O)O

Isomeric SMILES

CCCCC#CC1(C(CC2C1(CC(C3=C4CCC(=O)C=C4CCC23)C5=CC=C(C=C5)C(C)(C)C)C)O)O

InChI

InChI=1S/C34H44O3/c1-6-7-8-9-18-34(37)30(36)20-29-27-16-12-23-19-25(35)15-17-26(23)31(27)28(21-33(29,34)5)22-10-13-24(14-11-22)32(2,3)4/h10-11,13-14,19,27-30,36-37H,6-8,12,15-17,20-21H2,1-5H3