Mol:Coptisine Chloride
From Metabolomics.JP
ACD/Labs12070717012D 25 29 0 0 0 0 0 0 0 0 2 V2000 26.9506 -8.0841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.9506 -9.4141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.7987 -7.4191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.7987 -10.0791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.6469 -8.0841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.6469 -9.4141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 29.2543 -8.0841 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 29.2543 -9.4141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.1024 -7.4191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.1024 -10.0791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.4951 -7.4192 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.3434 -8.0843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.3434 -9.4142 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 30.4062 -6.0891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 30.4062 -7.4191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 29.2543 -5.4241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.1025 -6.0891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 31.5581 -4.0941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 31.5581 -5.4241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 30.4062 -3.4291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 29.2544 -4.0941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 33.8619 -4.0941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 33.8619 -5.4241 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 32.7099 -3.4291 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 29.3241 -12.1463 0.0000 Cl 0 5 0 0 0 0 0 0 0 0 0 0 3 1 2 0 0 0 0 4 2 2 0 0 0 0 5 3 1 0 0 0 0 6 4 1 0 0 0 0 6 5 2 0 0 0 0 8 7 1 0 0 0 0 10 8 1 0 0 0 0 1 9 1 0 0 0 0 2 10 1 0 0 0 0 2 1 1 0 0 0 0 11 5 1 0 0 0 0 12 11 1 0 0 0 0 13 12 1 0 0 0 0 15 14 2 0 0 0 0 16 14 1 0 0 0 0 7 15 1 0 0 0 0 17 16 2 0 0 0 0 9 7 2 0 0 0 0 9 17 1 0 0 0 0 20 18 1 0 0 0 0 14 19 1 0 0 0 0 21 20 2 0 0 0 0 16 21 1 0 0 0 0 23 22 1 0 0 0 0 24 22 1 0 0 0 0 18 24 1 0 0 0 0 19 18 2 0 0 0 0 13 6 1 0 0 0 0 23 19 1 0 0 0 0 M CHG 2 7 1 25 -1 S SKP 5 ID Coptisine Chloride FORMULA C19H14ClNO4 EXACTMASS 355.061135651 AVERAGEMASS 355.77149999999995 SMILES [Cl-1] M END
