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2-(9-chloranyl-6-fluoranyl-10,13,16-trimethyl-11-oxidanyl-3-oxidanylidene-7,8,11,12,14,15,16,17-octahydro-6H-cyclopenta[a]phenanthren-17-yl)-2-oxidanylidene-ethanoic acid

2-(9-chloranyl-6-fluoranyl-10,13,16-trimethyl-11-oxidanyl-3-oxidanylidene-7,8,11,12,14,15,16,17-octahydro-6H-cyclopenta[a]phenanthren-17-yl)-2-oxidanylidene-ethanoic acid

Systemtic Name:2-(9-chloranyl-6-fluoranyl-10,13,16-trimethyl-11-oxidanyl-3-oxidanylidene-7,8,11,12,14,15,16,17-octahydro-6H-cyclopenta[a]phenanthren-17-yl)-2-oxidanylidene-ethanoic acid
Openeye Name:2-(9-chloro-6-fluoro-11-hydroxy-10,13,16-trimethyl-3-oxo-7,8,11,12,14,15,16,17-octahydro-6H-cyclopenta[a]phenanthren-17-yl)-2-oxo-acetic acid
CAS Name:2-(9-chloro-6-fluoro-11-hydroxy-10,13,16-trimethyl-3-oxo-7,8,11,12,14,15,16,17-octahydro-6H-cyclopenta[a]phenanthren-17-yl)-2-oxoacetic acid
IUPAC Name:2-(9-chloro-6-fluoro-11-hydroxy-10,13,16-trimethyl-3-oxo-7,8,11,12,14,15,16,17-octahydro-6H-cyclopenta[a]phenanthren-17-yl)-2-oxoacetic acid
Traditional Name:2-(9-chloro-6-fluoro-11-hydroxy-3-keto-10,13,16-trimethyl-7,8,11,12,14,15,16,17-octahydro-6H-cyclopenta[a]phenanthren-17-yl)-2-keto-acetic acid
Formula: C22H26ClFO5
MolecularWeight: 424.890243
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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2C3CC(C4=CC(=O)C=CC4(C3(C(CC2(C1C(=O)C(=O)O)C)O)Cl)C)F


Isomeric SMILES

CC1CC2C3CC(C4=CC(=O)C=CC4(C3(C(CC2(C1C(=O)C(=O)O)C)O)Cl)C)F


InChI

InChI=1S/C22H26ClFO5/c1-10-6-12-13-8-15(24)14-7-11(25)4-5-21(14,3)22(13,23)16(26)9-20(12,2)17(10)18(27)19(28)29/h4-5,7,10,12-13,15-17,26H,6,8-9H2,1-3H3,(H,28,29)


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