Ketcher 08071512292D 1 1.00000 0.00000 0 36 35 0 0 0 999 V2000 12.9599 -7.5967 0.0000 Na 0 0 0 0 0 0 0 0 0 0 0 0 17.4509 -6.0880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.0514 -4.4630 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.5735 -6.6365 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.1737 -5.0114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3408 -6.5716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4064 -5.0764 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2514 -4.5483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.1859 -6.0435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6836 -6.1530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6383 -7.6807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9243 -5.2184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7276 -9.7040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5281 -8.1641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8385 -6.6812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7931 -8.2088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6594 -5.1739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9364 -6.2506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8053 -9.2409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7695 -4.6903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5726 -9.1759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2050 -3.5527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.0603 -6.5215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.0836 -7.5178 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.9116 -6.0032 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.4547 -9.6397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7740 -10.6995 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9601 -9.7691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9949 -10.7651 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.0801 -9.3013 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.8385 -7.6835 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 13.9776 -8.1824 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.6591 -7.5634 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.2110 -8.4947 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9839 -9.8181 0.0000 Na 0 0 0 0 0 0 0 0 0 0 0 0 21.9534 -6.3720 0.0000 Na 0 0 0 0 0 0 0 0 0 0 0 0 4 2 2 0 0 0 6 2 1 0 0 0 7 2 1 0 0 0 5 3 2 0 0 0 10 4 1 0 0 0 11 4 1 0 0 0 8 5 1 0 0 0 9 5 1 0 0 0 9 6 2 0 0 0 8 7 2 0 0 0 15 10 2 0 0 0 17 10 1 0 0 0 14 11 2 0 0 0 16 11 1 0 0 0 20 12 1 0 0 0 18 12 2 0 0 0 19 13 1 0 0 0 21 13 2 0 0 0 21 14 1 0 0 0 18 15 1 0 0 0 19 16 2 0 0 0 20 17 2 0 0 0 8 22 1 0 0 0 24 23 2 0 0 0 25 23 1 0 0 0 9 23 1 0 0 0 21 26 1 0 0 0 13 27 1 0 0 0 29 28 2 0 0 0 30 28 1 0 0 0 19 28 1 0 0 0 15 31 1 0 0 0 31 32 1 0 0 0 31 33 2 0 0 0 31 34 2 0 0 0 M CHG 6 1 1 25 -1 30 -1 32 -1 35 1 36 1 M END > CHEBI:87376 > chromoxane cyanin R > An organic sodium salt that is the trisodium salt of 5-[(3-carboxy-5-methyl-4-oxocyclohexa-2,5-dien-1-ylidene)(2-sulfophenyl)methyl]-2-hydroxy-3-methylbenzoic acid. It can be used for the detection of some metals in tissue. > 3 > solochrome cyanin R; mordant blue 3; eriochrome cyanin R; Chrome Cyanine R; C.I. Mordant Blue 3; C.I. 43820; alizarol cyanin R > trisodium 5-[(3-carboxylato-5-methyl-4-oxocyclohexa-2,5-dien-1-ylidene)(2-sulfonatophenyl)methyl]-2-hydroxy-3-methylbenzoate > C23H15Na3O9S > 536.39400 > 536.01299 > 0 > [Na+].[Na+].[Na+].CC1=C\C(C=C(C([O-])=O)C1=O)=C(\c1cc(C)c(O)c(c1)C([O-])=O)c1ccccc1S([O-])(=O)=O > InChI=1S/C23H18O9S.3Na/c1-11-7-13(9-16(20(11)24)22(26)27)19(15-5-3-4-6-18(15)33(30,31)32)14-8-12(2)21(25)17(10-14)23(28)29;;;/h3-10,24H,1-2H3,(H,26,27)(H,28,29)(H,30,31,32);;;/q;3*+1/p-3/b19-14+;;; > FFUMCSDSJNSMQH-HEXQVDJKSA-K > 3564-18-9 > 3873874 > 3564-18-9 > 4142136; 80845 $$$$