(5R,10S,13S,17R)-10,13-dimethyl-17-[(4R)-2-methyl-1,3,2-dioxaborolan-4-yl]-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-17-ol

Systemtic Name: (5R,10S,13S,17R)-10,13-dimethyl-17-[(4R)-2-methyl-1,3,2-dioxaborolan-4-yl]-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-17-ol Openeye Name: (5R,10S,13S,17R)-10,13-dimethyl-17-[(4R)-2-methyl-1,3,2-dioxaborolan-4-yl]-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-17-ol CAS Name: (5R,10S,13S,17R)-10,13-dimethyl-17-[(4R)-2-methyl-1,3,2-dioxaborolan-4-yl]-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-17-ol IUPAC Name: (5R,10S,13S,17R)-10,13-dimethyl-17-[(4R)-2-methyl-1,3,2-dioxaborolan-4-yl]-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-17-ol Traditional Name: (5R,10S,13S,17R)-10,13-dimethyl-17-[(4R)-2-methyl-1,3,2-dioxaborolan-4-yl]-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-17-ol Formula: C22H37BO3 MolecularWeight: 360.33838

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Descriptors Computed from Structure

Canonical SMILES:

B1(OCC(O1)C2(CCC3C2(CCC4C3CCC5C4(CCCC5)C)C)O)C

Isomeric SMILES

B1(OC[C@@H](O1)[C@]2(CCC3[C@@]2(CCC4C3CC[C@@H]5[C@@]4(CCCC5)C)C)O)C

InChI

InChI=1S/C22H37BO3/c1-20-11-5-4-6-15(20)7-8-16-17(20)9-12-21(2)18(16)10-13-22(21,24)19-14-25-23(3)26-19/h15-19,24H,4-14H2,1-3H3/t15-,16?,17?,18?,19-,20+,21+,22+/m1/s1