(Translated by https://www.hiragana.jp/)
Marvin 12100911412D 22 25 0 0 0 0 999 V2000 15.4267 -10.4561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4267 -11.2926 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.1377 -11.7109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8488 -11.2926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8488 -10.4561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1377 -10.0378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1377 -12.5475 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.6854 -11.5436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1455 -10.8743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6854 -10.1633 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.0200 -12.2965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8566 -12.3801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3167 -11.7109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9820 -10.9580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6738 -11.7109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9627 -11.2926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9364 -9.3686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9627 -10.4561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6738 -10.0378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1680 -10.2051 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7079 -10.8743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1680 -11.5436 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 1 6 1 0 0 0 0 3 7 2 0 0 0 0 4 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 5 10 1 0 0 0 0 8 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 9 14 2 0 0 0 0 2 15 1 0 0 0 0 15 16 1 0 0 0 0 10 17 1 0 0 0 0 16 18 2 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 16 22 1 0 0 0 0 M END > CHEBI:253342 > alosetron > A pyrido[4,3-b]indole compound having a 5-methyl-1H-imidazol-4-ylmethyl group at the 2-position. > 3 > 2,3,4,5-Tetrahydro-5-methyl-2-((5-methyl-1H-imidazol-4-yl)methyl)-1H-pyrido(4,3-b)indol-1-one > 5-methyl-2-[(5-methyl-1H-imidazol-4-yl)methyl]-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indol-1-one > alosetron > C17H18N4O > 294.35100 > 294.14806 > 0 > Cc1[nH]cnc1CN1CCc2c(C1=O)c1ccccc1n2C > InChI=1S/C17H18N4O/c1-11-13(19-10-18-11)9-21-8-7-15-16(17(21)22)12-5-3-4-6-14(12)20(15)2/h3-6,10H,7-9H2,1-2H3,(H,18,19) > JSWZEAMFRNKZNL-UHFFFAOYSA-N > 7140558 > 122852-42-0 > 122852-42-0 > DB00969 > D07129 > LSM-5576 > Alosetron $$$$