137628475 CDK 1019211303 44 44 0 0 0 0 0 0 0 0999 V2000 5.3048 -2.3682 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4276 -4.1891 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4002 -3.3997 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5079 -0.9318 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3644 -1.3443 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9039 -3.4068 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0789 -5.8818 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0192 -4.7725 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0789 -2.5818 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3644 -4.6443 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0789 -0.1068 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7337 -2.3682 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.0192 -2.7807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7337 -1.5432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4482 -1.1307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0192 -3.6057 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.4482 -0.3057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4482 -2.7807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1626 0.1068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1626 0.9318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8772 1.3443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3647 -3.1035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8772 2.1693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6026 -4.1891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5916 2.5818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5916 3.4068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3061 3.8193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5079 -2.5818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3061 4.6443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7934 -2.1693 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.0205 5.0568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7934 -1.3443 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.0205 5.8818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7350 4.6443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2223 -4.6443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0789 -0.9318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0789 -3.4068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5079 -5.0568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3644 -3.8193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0980 -3.8287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7934 -4.6443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0789 -5.0568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -5.0568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1862 -1.8186 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 28 1 0 0 0 0 2 24 2 0 0 0 0 3 28 2 0 0 0 0 32 4 1 1 0 0 0 5 36 2 0 0 0 0 6 37 2 0 0 0 0 7 42 2 0 0 0 0 8 24 1 0 0 0 0 8 35 1 0 0 0 0 9 30 1 0 0 0 0 9 37 1 0 0 0 0 10 39 1 0 0 0 0 10 42 1 0 0 0 0 10 43 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 18 1 1 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 15 17 1 0 0 0 0 16 22 1 1 0 0 0 16 24 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 23 1 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 29 1 0 0 0 0 28 30 1 0 0 0 0 29 31 1 0 0 0 0 30 32 1 0 0 0 0 30 44 1 6 0 0 0 31 33 1 0 0 0 0 31 34 1 0 0 0 0 32 36 1 0 0 0 0 35 38 1 0 0 0 0 35 40 2 0 0 0 0 37 39 1 0 0 0 0 38 41 2 0 0 0 0 41 42 1 0 0 0 0 M END > CHEBI:181499 > (2S)-2-[(3S,9E,14S)-7,14-Dimethyl-11-methylidene-15-[(2R)-14-methylpentadecan-2-yl]-2,5,8,13-tetraoxo-1-oxa-4,7,12-triazacyclopentadec-9-en-3-yl]-2-hydroxyacetamide > 2 > (2S)-2-[(3S,9E,14S)-7,14-dimethyl-11-methylidene-15-[(2R)-14-methylpentadecan-2-yl]-2,5,8,13-tetraoxo-1-oxa-4,7,12-triazacyclopentadec-9-en-3-yl]-2-hydroxyacetamide > C32H54N4O7 > 606.805 > 606.39925 > 0 > O1C([C@@H](CCCCCCCCCCCC(C)C)C)[C@H](C)C(=O)NC(C=CC(=O)N(CC(=O)N[C@](C1=O)([C@H](O)C(=O)N)[H])C)=C > InChI=1S/C32H54N4O7/c1-21(2)16-14-12-10-8-7-9-11-13-15-17-22(3)29-24(5)31(41)34-23(4)18-19-26(38)36(6)20-25(37)35-27(32(42)43-29)28(39)30(33)40/h18-19,21-22,24,27-29,39H,4,7-17,20H2,1-3,5-6H3,(H2,33,40)(H,34,41)(H,35,37)/b19-18+/t22-,24+,27+,28+,29?/m1/s1 > NODOLTRBPIFGCQ-CEIJAINISA-N $$$$