Ketcher 05041712232D 1 1.00000 0.00000 0 21 24 0 0 0 999 V2000 4.4455 -11.7441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4455 -12.7443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5792 -11.2439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5792 -13.2445 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7130 -11.7441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7130 -12.7443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3118 -11.2440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1779 -11.7442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3117 -13.2445 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1779 -12.7443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3119 -10.2438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1782 -9.7438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0442 -11.2442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0443 -10.2440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9954 -11.5534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5834 -10.7443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9957 -9.9350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0501 -9.2434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4470 -10.7498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3050 -8.9837 0.0000 R 0 0 0 0 0 0 0 0 0 0 0 0 4.4459 -9.7437 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3 1 1 0 0 0 4 2 1 0 0 0 5 3 1 0 0 0 6 4 1 0 0 0 6 5 1 0 0 0 7 1 1 0 0 0 2 1 1 0 0 0 9 2 1 0 0 0 10 8 1 0 0 0 10 9 1 0 0 0 11 7 1 0 0 0 8 7 1 0 0 0 12 11 1 0 0 0 13 8 1 0 0 0 14 12 1 0 0 0 15 13 1 0 0 0 14 13 1 0 0 0 16 15 1 0 0 0 17 14 1 0 0 0 17 16 1 0 0 0 14 18 1 0 0 0 1 19 1 0 0 0 17 20 1 0 0 0 11 21 1 1 0 0 M END > CHEBI:35346 > 11beta-hydroxy steroid > Any 11-hydroxy steroid in which the hydroxy group at position 11 has β- configuration. > 3 > CHEBI:19134; CHEBI:738; CHEBI:13774 > an 11-beta-hydroxysteroid; 11beta-hydroxysteroids; 11beta-Hydroxysteroid; 11beta-hydroxy steroids > C19H31OR > 275.450 > 275.23749 > 0 > C12(CCCCC1CCC3C2[C@H](CC4(C3CCC4*)C)O)C > C01058 $$$$