null CDK 0225161910 null 33 35 0 0 0 0 0 0 0 0999 V2000 -1.3278 5.7911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5525 5.5090 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0222 6.1409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7903 6.2842 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5047 5.8717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1367 6.4020 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7869 5.0965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5047 4.3212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7903 3.9087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7903 3.0837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5047 2.6712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2192 3.0837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2192 3.9087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9337 2.6712 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6481 3.0837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6481 3.9087 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3626 2.6712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0771 3.0837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7915 2.6712 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5060 3.0837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2205 2.6712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2205 1.8462 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5060 1.4337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7915 1.8462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0222 4.0520 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5525 4.6840 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.3278 4.4018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9597 4.9321 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7350 4.6499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9335 7.0967 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.7088 7.3788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3015 7.6270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4448 8.4394 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 1 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 8 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 19 1 0 0 0 0 9 25 1 0 0 0 0 25 26 1 0 0 0 0 26 2 1 0 0 0 0 26 27 1 1 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 4 30 1 0 0 0 0 30 31 1 1 0 0 0 30 32 1 0 0 0 0 32 33 1 0 0 0 0 M END > CHEBI:124244 > N-[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-3-(4-morpholinyl)propanamide > 2 > C24H38N4O5 > 462.583 > 462.28422 > 0 > C[C@H]1CN(C(=O)CC2=C(C=CC(=C2)NC(=O)CCN3CCOCC3)O[C@H]1CNC)[C@H](C)CO > InChI=1S/C24H38N4O5/c1-17-15-28(18(2)16-29)24(31)13-19-12-20(4-5-21(19)33-22(17)14-25-3)26-23(30)6-7-27-8-10-32-11-9-27/h4-5,12,17-18,22,25,29H,6-11,13-16H2,1-3H3,(H,26,30)/t17-,18+,22-/m0/s1 > QKNVOCCOOAXREN-SVMVAKDDSA-N > LSM-35686 $$$$