67217379 -OEChem-04252423452D 84 87 0 1 0 0 0 0 0999 V2000 5.4641 0.5333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.1901 1.7653 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 2.0333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.1901 0.0333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2493 -2.4663 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.8312 -2.5468 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -0.4667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.6901 0.8993 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 13.1901 0.0333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1901 0.0333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.5333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6065 -0.7715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 0.5333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1901 1.7653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6065 0.8380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 0.5333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 1.0333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 1.0333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6901 2.6314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.0333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -0.9667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6901 0.8993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -0.4667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6962 1.3993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6962 -0.3328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9171 -1.7220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1901 3.4974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8956 -1.9282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.0333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1901 1.7653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2063 -2.8787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5635 -1.1839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.5333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1848 -3.0849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5420 -1.3901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6901 2.6314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8527 -2.3406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.0333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.5333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.5333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.0333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.5333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1418 -3.4974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0701 0.8993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0824 -0.5773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7727 -0.1788 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7151 2.1638 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7151 1.3668 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7991 1.4273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 1.6533 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1650 2.2328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1650 3.0299 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9316 -0.4417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7287 -0.4417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -1.5867 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3913 -0.7767 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2331 1.7093 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3862 1.9362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1592 1.0893 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1592 -0.6428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0062 -0.8697 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2331 -0.0228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7270 3.8074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8801 4.0343 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6531 3.1874 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1996 -0.4417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9966 -0.4417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0824 1.1547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7727 1.5533 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7922 -3.3402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3709 -0.5946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3774 -3.6743 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9561 -0.9286 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.2270 2.3213 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0001 3.1683 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1531 2.9414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.5867 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 1.8433 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 0.2233 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.6533 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 1.8433 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5525 -3.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3344 -4.0867 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7311 -3.3048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 1 29 1 0 0 0 0 2 22 1 0 0 0 0 2 30 1 0 0 0 0 3 17 2 0 0 0 0 4 22 2 0 0 0 0 5 26 2 0 0 0 0 6 37 1 0 0 0 0 6 43 1 0 0 0 0 7 12 1 0 0 0 0 7 13 1 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 8 14 1 0 0 0 0 8 22 1 0 0 0 0 8 44 1 0 0 0 0 9 10 1 0 0 0 0 9 45 1 0 0 0 0 9 46 1 0 0 0 0 10 12 2 0 0 0 0 10 15 1 0 0 0 0 11 17 1 0 0 0 0 11 20 1 0 0 0 0 11 24 1 0 0 0 0 11 25 1 0 0 0 0 12 26 1 0 0 0 0 13 15 2 0 0 0 0 13 18 1 0 0 0 0 14 19 1 0 0 0 0 14 47 1 0 0 0 0 14 48 1 0 0 0 0 15 49 1 0 0 0 0 16 17 1 0 0 0 0 16 18 2 0 0 0 0 16 23 1 0 0 0 0 18 50 1 0 0 0 0 19 27 1 0 0 0 0 19 51 1 0 0 0 0 19 52 1 0 0 0 0 20 53 1 0 0 0 0 20 54 1 0 0 0 0 21 23 2 0 0 0 0 21 55 1 0 0 0 0 23 56 1 0 0 0 0 24 57 1 0 0 0 0 24 58 1 0 0 0 0 24 59 1 0 0 0 0 25 60 1 0 0 0 0 25 61 1 0 0 0 0 25 62 1 0 0 0 0 26 28 1 0 0 0 0 27 63 1 0 0 0 0 27 64 1 0 0 0 0 27 65 1 0 0 0 0 28 31 2 0 0 0 0 28 32 1 0 0 0 0 29 33 1 0 0 0 0 29 66 1 0 0 0 0 29 67 1 0 0 0 0 30 36 1 0 0 0 0 30 68 1 0 0 0 0 30 69 1 0 0 0 0 31 34 1 0 0 0 0 31 70 1 0 0 0 0 32 35 2 0 0 0 0 32 71 1 0 0 0 0 33 38 2 0 0 0 0 33 39 1 0 0 0 0 34 37 2 0 0 0 0 34 72 1 0 0 0 0 35 37 1 0 0 0 0 35 73 1 0 0 0 0 36 74 1 0 0 0 0 36 75 1 0 0 0 0 36 76 1 0 0 0 0 38 40 1 0 0 0 0 38 77 1 0 0 0 0 39 41 2 0 0 0 0 39 78 1 0 0 0 0 40 42 2 0 0 0 0 40 79 1 0 0 0 0 41 42 1 0 0 0 0 41 80 1 0 0 0 0 42 81 1 0 0 0 0 43 82 1 0 0 0 0 43 83 1 0 0 0 0 43 84 1 0 0 0 0 M END > 67217379 > 1 > 905 > 6 > 0 > 16 > AAADcfB+OAAAAAAAAAAAAAAAAAAAAWAAAAA8YIAAAAAAAFgB9AAAHgAAAAAADwzhngY+zrMMHACoA7T3TACCiCA3IiAI2CG+bNgMJvbEtbuGMShk4BHI6Yec3ePfIAAAAAAAAABAAAAAAAAAAAAAAAAAAA== > ethyl 2-[[7-(3-benzyloxy-2,2-dimethyl-propanoyl)-3-(4-methoxybenzoyl)indolizin-2-yl]methyl]pentanoate > 2-[[7-(2,2-dimethyl-1-oxo-3-phenylmethoxypropyl)-3-[(4-methoxyphenyl)-oxomethyl]-2-indolizinyl]methyl]pentanoic acid ethyl ester > ethyl 2-[[7-(2,2-dimethyl-3-phenylmethoxypropanoyl)-3-(4-methoxybenzoyl)indolizin-2-yl]methyl]pentanoate > ethyl 2-[[7-(2,2-dimethyl-3-phenylmethoxypropanoyl)-3-(4-methoxybenzoyl)indolizin-2-yl]methyl]pentanoate > ethyl 2-[[7-(2,2-dimethyl-3-phenylmethoxy-propanoyl)-3-(4-methoxyphenyl)carbonyl-indolizin-2-yl]methyl]pentanoate > 2-[[7-(3-benzoxy-2,2-dimethyl-propanoyl)-3-p-anisoyl-indolizin-2-yl]methyl]valeric acid ethyl ester > InChI=1S/C36H41NO6/c1-6-11-28(35(40)43-7-2)20-29-22-30-21-27(34(39)36(3,4)24-42-23-25-12-9-8-10-13-25)18-19-37(30)32(29)33(38)26-14-16-31(41-5)17-15-26/h8-10,12-19,21-22,28H,6-7,11,20,23-24H2,1-5H3 > VSEDKERDOVSKQA-UHFFFAOYSA-N > 8 > 583.29338803 > C36H41NO6 > 583.7 > CCCC(CC1=C(N2C=CC(=CC2=C1)C(=O)C(C)(C)COCC3=CC=CC=C3)C(=O)C4=CC=C(C=C4)OC)C(=O)OCC > CCCC(CC1=C(N2C=CC(=CC2=C1)C(=O)C(C)(C)COCC3=CC=CC=C3)C(=O)C4=CC=C(C=C4)OC)C(=O)OCC > 83.3 > 583.29338803 > 0 > 43 > 0 > 1 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 10 12 8 10 15 8 13 15 8 13 18 8 16 18 8 16 23 8 21 23 8 28 31 8 28 32 8 31 34 8 32 35 8 33 38 8 33 39 8 34 37 8 35 37 8 38 40 8 39 41 8 40 42 8 41 42 8 7 12 8 7 13 8 7 21 8 8 14 3 $$$$