CDK 1028232202 25 27 0 0 0 0 0 0 0 0999 V2000 0.0000 -3.7125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -2.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7144 -2.4750 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7144 -2.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7144 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4290 -2.8875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7144 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3595 -2.9894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -1.2375 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4290 -1.2375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1434 -2.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4290 -3.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3595 -1.1356 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1638 -2.8058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1434 -0.8250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1434 -1.6500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4290 -0.4125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.8579 -2.8875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1638 -1.3192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6782 -3.4508 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5217 -2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7144 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1434 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3768 -4.2188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 5 1 0 0 0 0 6 3 1 0 0 0 0 4 7 2 0 0 0 0 4 8 1 0 0 0 0 5 9 2 0 0 0 0 10 5 1 0 0 0 0 6 11 1 0 0 0 0 6 12 1 1 0 0 0 7 13 1 0 0 0 0 8 14 2 0 0 0 0 10 15 1 6 0 0 0 10 16 1 0 0 0 0 17 10 1 0 0 0 0 11 18 2 0 0 0 0 13 19 1 0 0 0 0 14 20 1 0 0 0 0 14 21 1 0 0 0 0 17 22 1 0 0 0 0 17 23 1 6 0 0 0 20 24 1 0 0 0 0 22 25 1 0 0 0 0 7 9 1 0 0 0 0 11 16 1 0 0 0 0 19 21 2 0 0 0 0 M END > CHEBI:199372 > Oxepinamide B > 2 > (4S,7R)-4-[(2S)-butan-2-yl]-4-hydroxy-12-methoxy-7-methyl-15-oxa-2,5,8-triazatricyclo[8.5.0.03,8]pentadeca-1(10),2,11,13-tetraene-6,9-dione > C17H21N3O5 > 347.371 > 347.14812 > 0 > O=C1N2C(=NC3=C1C=C(OC)C=CO3)[C@](O)(NC([C@H]2C)=O)[C@H](CC)C > InChI=1S/C17H21N3O5/c1-5-9(2)17(23)16-18-14-12(8-11(24-4)6-7-25-14)15(22)20(16)10(3)13(21)19-17/h6-10,23H,5H2,1-4H3,(H,19,21)/t9-,10+,17-/m0/s1 > LNZVLFKJDOYTAA-GBNMTWHSSA-N $$$$