58715609 -OEChem-03292411572D 58 60 0 1 0 0 0 0 0999 V2000 5.3788 -2.2731 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9077 -2.5513 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0622 -3.4400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8777 -1.0613 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2948 -0.5920 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7031 1.2084 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0052 3.0308 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4447 2.2793 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8786 1.3783 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.8786 1.3783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5021 0.5965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2796 -0.3784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2551 0.5965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3786 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4776 -0.3784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1491 -0.9519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2847 -1.8497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0793 -1.9912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3686 1.0161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1408 -2.4431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8610 -1.1411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0450 -0.5076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4866 0.5870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8802 -1.1372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0080 3.1055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2697 -0.3695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5741 4.0065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2926 -3.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8070 -2.1139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8863 -4.0065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.5476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2084 1.9033 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4372 1.6473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7406 1.9828 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0607 0.3275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8886 1.0812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8264 2.3256 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3652 1.6361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1270 -1.7012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4728 -0.0588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6773 -0.0084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6097 -1.6950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1327 4.2755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3051 4.5651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0155 3.7375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4332 -0.7859 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6749 -3.2159 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2391 -3.8871 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9102 -3.3229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0781 -2.6715 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3646 -1.8428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5358 -1.5564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5351 -4.5174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3972 -4.3577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2375 -3.4956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4075 -1.3649 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8172 -2.1401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5925 -1.7304 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 1 0 0 0 0 1 28 1 0 0 0 0 2 18 1 0 0 0 0 2 29 1 0 0 0 0 3 20 1 0 0 0 0 3 30 1 0 0 0 0 4 22 1 0 0 0 0 4 46 1 0 0 0 0 5 26 1 0 0 0 0 5 31 1 0 0 0 0 6 23 2 0 0 0 0 7 25 2 0 0 0 0 9 8 1 6 0 0 0 8 25 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 14 1 0 0 0 0 12 16 2 0 0 0 0 13 15 1 0 0 0 0 13 19 2 0 0 0 0 14 15 1 0 0 0 0 14 17 2 0 0 0 0 15 21 2 0 0 0 0 16 18 1 0 0 0 0 16 22 1 0 0 0 0 17 20 1 0 0 0 0 18 20 2 0 0 0 0 19 23 1 0 0 0 0 19 38 1 0 0 0 0 21 24 1 0 0 0 0 21 39 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 23 26 1 0 0 0 0 24 26 2 0 0 0 0 24 42 1 0 0 0 0 25 27 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 31 56 1 0 0 0 0 31 57 1 0 0 0 0 31 58 1 0 0 0 0 M END > 58715609 > 1 > 787 > 7 > 2 > 6 > AAADceB6OAAAAAAAAAAAAAAAAAAAAAAAAAAwAAAABggAAAABAAAAHgAQCAAADCzhmAYCBoLABgCIAqFSEAKCCAAgIAAAiIBMiMgNNyKEsR6EcCIl1hWKuYfQ8P8OoAADCAAYQABAAAYQADCAAAAAAAAAAA== > N-[(7R)-4-(hydroxymethyl)-1,2,3,10-tetramethoxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]acetamide > N-[(7R)-4-(hydroxymethyl)-1,2,3,10-tetramethoxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]acetamide > N-[(7R)-4-(hydroxymethyl)-1,2,3,10-tetramethoxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]acetamide > N-[(7R)-4-(hydroxymethyl)-1,2,3,10-tetramethoxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]acetamide > N-[(7R)-4-(hydroxymethyl)-1,2,3,10-tetramethoxy-9-oxidanylidene-6,7-dihydro-5H-benzo[a]heptalen-7-yl]ethanamide > N-[(7R)-9-keto-1,2,3,10-tetramethoxy-4-methylol-6,7-dihydro-5H-benzo[a]heptalen-7-yl]acetamide > InChI=1S/C23H27NO7/c1-12(26)24-17-8-6-14-16(11-25)21(29-3)23(31-5)22(30-4)20(14)13-7-9-19(28-2)18(27)10-15(13)17/h7,9-10,17,25H,6,8,11H2,1-5H3,(H,24,26)/t17-/m1/s1 > XOAUTVKFAKCYKZ-QGZVFWFLSA-N > 0.1 > 429.17875220 > C23H27NO7 > 429.5 > CC(=O)NC1CCC2=C(C(=C(C(=C2C3=CC=C(C(=O)C=C13)OC)OC)OC)OC)CO > CC(=O)N[C@@H]1CCC2=C(C(=C(C(=C2C3=CC=C(C(=O)C=C13)OC)OC)OC)OC)CO > 103 > 429.17875220 > 0 > 31 > 1 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 12 14 8 12 16 8 13 15 8 13 19 8 14 17 8 15 21 8 16 18 8 17 20 8 18 20 8 19 23 8 21 24 8 23 26 8 24 26 8 9 8 6 $$$$