60192759 -OEChem-04262403202D 67 69 0 1 0 0 0 0 0999 V2000 5.0000 -4.7733 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.4432 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1578 3.1052 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1980 -1.1844 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8898 3.0986 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -2.1752 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8660 -2.5412 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0180 1.6019 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8937 4.0986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7050 4.6832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0869 4.6895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3996 5.6355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3996 5.6393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -3.9073 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5000 -3.9073 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.0000 -3.0412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 -3.0412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -4.7733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -1.3092 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.0219 2.6019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -0.4432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2320 -1.4432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.3092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2320 -0.4432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3660 0.0568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5074 -3.3085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1501 1.1053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1420 0.0637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -5.6393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3500 1.0983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2480 1.6261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4450 3.8150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0129 4.1451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2723 4.9332 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5215 4.9438 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7749 4.1537 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0066 5.7620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3372 6.2523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4668 6.2557 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7937 5.7706 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8800 -3.9073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1900 -4.4442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4256 2.7865 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5250 -2.6427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5250 -3.4398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8923 -2.4307 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4384 -3.4797 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4631 -4.4633 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6900 -5.3102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5369 -5.0833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6900 -1.8461 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1200 -2.1752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6077 0.1674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9174 -0.2311 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.6892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 -1.3092 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.9292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5538 1.2899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0318 -3.7061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9051 -3.7841 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9831 -2.9108 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6754 -0.2525 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9631 -5.3293 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1900 -6.1763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0369 -5.9493 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8095 1.4021 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2456 2.2461 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15 1 1 6 0 0 0 1 29 1 0 0 0 0 2 21 1 0 0 0 0 2 25 1 0 0 0 0 3 20 2 0 0 0 0 4 22 2 0 0 0 0 5 9 1 0 0 0 0 5 20 1 0 0 0 0 5 43 1 0 0 0 0 6 16 1 0 0 0 0 6 19 1 0 0 0 0 6 52 1 0 0 0 0 7 17 1 0 0 0 0 7 22 1 0 0 0 0 7 26 1 0 0 0 0 8 20 1 0 0 0 0 8 27 1 0 0 0 0 8 58 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 32 1 0 0 0 0 10 12 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 13 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 18 1 6 0 0 0 14 41 1 0 0 0 0 15 17 1 0 0 0 0 15 42 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 17 46 1 0 0 0 0 17 47 1 0 0 0 0 18 48 1 0 0 0 0 18 49 1 0 0 0 0 18 50 1 0 0 0 0 19 21 1 0 0 0 0 19 23 1 1 0 0 0 19 51 1 0 0 0 0 21 53 1 0 0 0 0 21 54 1 0 0 0 0 22 24 1 0 0 0 0 23 55 1 0 0 0 0 23 56 1 0 0 0 0 23 57 1 0 0 0 0 24 25 2 0 0 0 0 24 28 1 0 0 0 0 25 30 1 0 0 0 0 26 59 1 0 0 0 0 26 60 1 0 0 0 0 26 61 1 0 0 0 0 27 28 2 0 0 0 0 27 31 1 0 0 0 0 28 62 1 0 0 0 0 29 63 1 0 0 0 0 29 64 1 0 0 0 0 29 65 1 0 0 0 0 30 31 2 0 0 0 0 30 66 1 0 0 0 0 31 67 1 0 0 0 0 M END > 60192759 > 1 > 598 > 5 > 3 > 3 > AAADcfB7uAAAAAAAAAAAAAAAAAAAAYAAAAAwAAAAAAAAAAABAAAAHgAQAAAADTzhmAYzxoPABACIAiVSUACCCAAlIgAIiIEObMiOJjbEtZuHOWju9hPY6ae8yCCOAEAAQAAIAAAAgACAABAAAAAAAAAAAA== > 1-cyclopentyl-3-[(4S,7R,8R)-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]urea > 1-cyclopentyl-3-[(4S,7R,8R)-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]urea > 1-cyclopentyl-3-[(4S,7R,8R)-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]urea > 1-cyclopentyl-3-[(4S,7R,8R)-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]urea > 1-cyclopentyl-3-[(4S,7R,8R)-8-methoxy-4,7,10-trimethyl-11-oxidanylidene-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]urea > 1-cyclopentyl-3-[(4S,7R,8R)-11-keto-8-methoxy-4,7,10-trimethyl-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]urea > InChI=1S/C23H36N4O4/c1-15-12-24-16(2)14-31-20-10-9-18(26-23(29)25-17-7-5-6-8-17)11-19(20)22(28)27(3)13-21(15)30-4/h9-11,15-17,21,24H,5-8,12-14H2,1-4H3,(H2,25,26,29)/t15-,16+,21+/m1/s1 > CYBXXMFHQYVKCO-XFQAVAEZSA-N > 2.1 > 432.27365564 > C23H36N4O4 > 432.6 > CC1CNC(COC2=C(C=C(C=C2)NC(=O)NC3CCCC3)C(=O)N(CC1OC)C)C > C[C@@H]1CN[C@H](COC2=C(C=C(C=C2)NC(=O)NC3CCCC3)C(=O)N(C[C@@H]1OC)C)C > 91.9 > 432.27365564 > 0 > 31 > 3 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 15 1 6 14 18 6 19 23 5 24 25 8 24 28 8 25 30 8 27 28 8 27 31 8 30 31 8 $$$$