54664479 -OEChem-04262403432D 62 66 0 1 0 0 0 0 0999 V2000 3.4199 -0.2628 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4108 -2.9607 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6254 -0.8997 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2875 1.2287 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 8.8598 -1.0263 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9108 -2.0947 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5509 0.2461 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.8097 -0.7199 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.1520 -0.2628 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4108 -1.2287 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.5841 -0.0651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7875 2.0947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0307 -1.5855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2875 2.9607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2859 0.2372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9108 -2.0947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2930 3.0653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6942 3.8743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0851 4.0434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9511 4.5434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0874 -2.6256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8029 -1.4685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4108 -2.9607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8175 -3.8743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4163 -3.0653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0200 -3.0894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8836 -2.5070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0744 -4.5434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2083 -4.0434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3309 1.0671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0297 -1.5409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6601 -0.6402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8093 -1.7037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5892 0.5549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1985 0.0187 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2625 2.4932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2625 1.6962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9498 2.4408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8874 0.7122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6845 0.7122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2930 2.4453 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6764 3.0004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0587 4.3759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2312 3.5643 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4954 3.8518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8329 4.6098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5867 5.0450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4119 4.9583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5694 -2.9664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6008 -1.5578 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0299 -2.9932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3544 -3.5643 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1819 -4.3759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7996 -3.0004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4163 -2.4453 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8830 0.0472 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0609 -3.7081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4419 -2.7766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5351 -4.9583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7100 -5.0450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9562 -4.6098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6187 -3.8518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 1 56 1 0 0 0 0 2 16 2 0 0 0 0 3 22 2 0 0 0 0 4 7 1 0 0 0 0 4 8 1 0 0 0 0 4 12 1 0 0 0 0 5 11 1 0 0 0 0 5 13 1 0 0 0 0 5 22 1 0 0 0 0 6 16 1 0 0 0 0 6 23 1 0 0 0 0 6 50 1 0 0 0 0 7 9 1 0 0 0 0 7 11 1 0 0 0 0 7 30 1 6 0 0 0 8 10 1 0 0 0 0 8 13 1 0 0 0 0 8 31 1 1 0 0 0 9 10 1 0 0 0 0 9 15 1 1 0 0 0 9 32 1 0 0 0 0 10 16 1 6 0 0 0 10 33 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 14 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 21 2 0 0 0 0 14 17 1 0 0 0 0 14 18 1 0 0 0 0 14 38 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 17 19 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 20 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 21 26 1 0 0 0 0 21 49 1 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 51 1 0 0 0 0 24 28 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 25 29 1 0 0 0 0 25 54 1 0 0 0 0 25 55 1 0 0 0 0 26 27 2 0 0 0 0 26 57 1 0 0 0 0 27 58 1 0 0 0 0 28 29 1 0 0 0 0 28 59 1 0 0 0 0 28 60 1 0 0 0 0 29 61 1 0 0 0 0 29 62 1 0 0 0 0 M END > 54664479 > 1 > 721 > 4 > 2 > 5 > AAADcfB7MAAAAAAAAAAAAAAAAAAAAeMEAAAsQAAABYAAAACAAAAAHgAQCAAADSjhgAYAAAPAAgCIACVSUACAAAAgAgAICIEIAEgIUBoAwQAUQAAGlgCIgYO+EQIOgAAAAAAAAAAAAAAAAAAAAAAAAAAAAA== > (1S,9R,10R,11R)-N-cyclopentyl-12-(cyclopentylmethyl)-10-(hydroxymethyl)-6-oxo-7,12-diazatricyclo[7.2.1.02,7]dodeca-2,4-diene-11-carboxamide > (1S,9R,10R,11R)-N-cyclopentyl-12-(cyclopentylmethyl)-10-(hydroxymethyl)-6-oxo-7,12-diazatricyclo[7.2.1.02,7]dodeca-2,4-diene-11-carboxamide > (1S,9R,10R,11R)-N-cyclopentyl-12-(cyclopentylmethyl)-10-(hydroxymethyl)-6-oxo-7,12-diazatricyclo[7.2.1.02,7]dodeca-2,4-diene-11-carboxamide > (1S,9R,10R,11R)-N-cyclopentyl-12-(cyclopentylmethyl)-10-(hydroxymethyl)-6-oxo-7,12-diazatricyclo[7.2.1.02,7]dodeca-2,4-diene-11-carboxamide > (1S,9R,10R,11R)-N-cyclopentyl-12-(cyclopentylmethyl)-10-(hydroxymethyl)-6-oxidanylidene-7,12-diazatricyclo[7.2.1.02,7]dodeca-2,4-diene-11-carboxamide > (1S,9R,10R,11R)-N-cyclopentyl-12-(cyclopentylmethyl)-6-keto-10-methylol-7,12-diazatricyclo[7.2.1.02,7]dodeca-2,4-diene-11-carboxamide > InChI=1S/C23H33N3O3/c27-14-17-19-13-25-18(10-5-11-20(25)28)22(26(19)12-15-6-1-2-7-15)21(17)23(29)24-16-8-3-4-9-16/h5,10-11,15-17,19,21-22,27H,1-4,6-9,12-14H2,(H,24,29)/t17-,19-,21+,22+/m0/s1 > GJIKUUHOFPGRFJ-HVJHZFLKSA-N > 1.8 > 399.25219192 > C23H33N3O3 > 399.5 > C1CCC(C1)CN2C3CN4C(=O)C=CC=C4C2C(C3CO)C(=O)NC5CCCC5 > C1CCC(C1)CN2[C@H]3CN4C(=O)C=CC=C4[C@@H]2[C@@H]([C@H]3CO)C(=O)NC5CCCC5 > 72.9 > 399.25219192 > 0 > 29 > 4 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 10 16 6 13 21 8 21 26 8 22 27 8 26 27 8 5 13 8 5 22 8 7 30 6 8 31 5 9 15 5 $$$$