6057725 -OEChem-05102418492D 82 87 0 0 0 0 0 0 0999 V2000 4.5981 5.8081 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 19.4129 -2.8216 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.8081 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 17.6578 -5.8081 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.3465 1.7735 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0409 -3.2910 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 6.8081 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 20.2828 -2.3283 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 3.5981 5.8081 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 5.8081 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.9063 -3.6914 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.9196 -1.9517 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.3081 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 17.6501 -6.8081 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.3660 3.6741 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 1.9421 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.6578 -5.8158 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.6579 -5.8004 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.8081 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.9335 -4.7948 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1244 1.7840 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.1730 -1.7394 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1282 2.7840 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.0409 -1.2427 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 4.3081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6809 -2.8082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 3.3081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8111 -3.3015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 4.8081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5431 -3.3149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.8081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8034 -4.3015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.3081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6655 -4.8082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 4.3081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5354 -4.3148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3580 2.7734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9050 -2.7877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3580 4.8428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7050 -1.7669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 3.2873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9050 -1.7461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 4.3289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8111 -1.2322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7166 0.2740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5807 -0.2294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9884 1.2806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3089 -1.2360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8564 1.7773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4410 -1.7327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7205 1.2740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5769 -1.2294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8487 -0.2227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4487 0.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9846 0.2806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3128 -0.2361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8602 2.7773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4371 -2.7327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 4.6181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.0699 -4.6290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3509 5.4627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2478 -1.4673 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7998 4.6410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8183 -0.6123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2586 1.5819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0387 -1.5373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 1.4981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 1.4981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3990 -4.4807 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9288 -5.4148 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8463 -0.8427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4511 0.8873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4465 -0.0273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8509 0.0719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5862 1.4760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1706 -2.3594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4802 2.7749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8626 3.3973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2402 2.7797 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8171 -2.7303 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4347 -3.3527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0571 -2.7351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 9 2 0 0 0 0 1 10 2 0 0 0 0 1 29 1 0 0 0 0 2 8 1 0 0 0 0 2 11 2 0 0 0 0 2 12 2 0 0 0 0 2 30 1 0 0 0 0 3 13 1 0 0 0 0 3 15 2 0 0 0 0 3 16 2 0 0 0 0 3 33 1 0 0 0 0 4 14 1 0 0 0 0 4 17 2 0 0 0 0 4 18 2 0 0 0 0 4 34 1 0 0 0 0 5 37 2 0 0 0 0 6 38 2 0 0 0 0 19 31 1 0 0 0 0 19 67 1 0 0 0 0 19 68 1 0 0 0 0 20 32 1 0 0 0 0 20 69 1 0 0 0 0 20 70 1 0 0 0 0 21 23 1 0 0 0 0 21 47 1 0 0 0 0 21 75 1 0 0 0 0 22 24 1 0 0 0 0 22 48 1 0 0 0 0 22 76 1 0 0 0 0 23 41 2 0 0 0 0 24 42 2 0 0 0 0 25 27 2 0 0 0 0 25 29 1 0 0 0 0 25 39 1 0 0 0 0 26 28 2 0 0 0 0 26 30 1 0 0 0 0 26 40 1 0 0 0 0 27 31 1 0 0 0 0 27 37 1 0 0 0 0 28 32 1 0 0 0 0 28 38 1 0 0 0 0 29 35 2 0 0 0 0 30 36 2 0 0 0 0 31 33 2 0 0 0 0 32 34 2 0 0 0 0 33 35 1 0 0 0 0 34 36 1 0 0 0 0 35 59 1 0 0 0 0 36 60 1 0 0 0 0 37 41 1 0 0 0 0 38 42 1 0 0 0 0 39 43 2 0 0 0 0 39 61 1 0 0 0 0 40 44 2 0 0 0 0 40 62 1 0 0 0 0 41 43 1 0 0 0 0 42 44 1 0 0 0 0 43 63 1 0 0 0 0 44 64 1 0 0 0 0 45 46 1 0 0 0 0 45 51 2 0 0 0 0 45 53 1 0 0 0 0 46 52 2 0 0 0 0 46 54 1 0 0 0 0 47 49 2 0 0 0 0 47 55 1 0 0 0 0 48 50 2 0 0 0 0 48 56 1 0 0 0 0 49 51 1 0 0 0 0 49 57 1 0 0 0 0 50 52 1 0 0 0 0 50 58 1 0 0 0 0 51 65 1 0 0 0 0 52 66 1 0 0 0 0 53 55 2 0 0 0 0 53 71 1 0 0 0 0 54 56 2 0 0 0 0 54 72 1 0 0 0 0 55 73 1 0 0 0 0 56 74 1 0 0 0 0 57 77 1 0 0 0 0 57 78 1 0 0 0 0 57 79 1 0 0 0 0 58 80 1 0 0 0 0 58 81 1 0 0 0 0 58 82 1 0 0 0 0 M CHG 4 7 -1 8 -1 13 -1 14 -1 M END > 6057725 > 1 > 2000 > 20 > 4 > 5 > AAADceB/vABwAAAAAAAAAAAAAAAAAAAAAAAwYMGCAAAAAACBVAAAHgQYAAAADAyB2AAywYBiAAKoA6RyQHDSBEAkAgAYiB0wZNgIIDqAlZGAIYBgmAAIyUcYiMCOmAQCwEAWAQAwCAWAgCwCAAAAAAAAAA== > (6Z)-4-amino-6-[[4-[4-[(2Z)-2-(8-amino-1-oxo-5,7-disulfonato-2-naphthylidene)hydrazino]-3-methyl-phenyl]-2-methyl-phenyl]hydrazono]-5-oxo-naphthalene-1,3-disulfonate > (6Z)-4-amino-6-[[4-[4-[(2Z)-2-(8-amino-1-oxo-5,7-disulfonato-2-naphthalenylidene)hydrazinyl]-3-methylphenyl]-2-methylphenyl]hydrazinylidene]-5-oxonaphthalene-1,3-disulfonate > (6Z)-4-amino-6-[[4-[4-[(2Z)-2-(8-amino-1-oxo-5,7-disulfonatonaphthalen-2-ylidene)hydrazinyl]-3-methylphenyl]-2-methylphenyl]hydrazinylidene]-5-oxonaphthalene-1,3-disulfonate > (6Z)-4-amino-6-[[4-[4-[(2Z)-2-(8-amino-1-oxo-5,7-disulfonatonaphthalen-2-ylidene)hydrazinyl]-3-methylphenyl]-2-methylphenyl]hydrazinylidene]-5-oxonaphthalene-1,3-disulfonate > (6Z)-4-azanyl-6-[[4-[4-[(2Z)-2-(8-azanyl-1-oxidanylidene-5,7-disulfonato-naphthalen-2-ylidene)hydrazinyl]-3-methyl-phenyl]-2-methyl-phenyl]hydrazinylidene]-5-oxidanylidene-naphthalene-1,3-disulfonate > (6Z)-4-amino-6-[[4-[4-[(N'Z)-N'-(8-amino-1-keto-5,7-disulfonato-2-naphthylidene)hydrazino]-3-methyl-phenyl]-2-methyl-phenyl]hydrazono]-5-keto-naphthalene-1,3-disulfonate > InChI=1S/C34H28N6O14S4/c1-15-11-17(3-7-21(15)37-39-23-9-5-19-25(55(43,44)45)13-27(57(49,50)51)31(35)29(19)33(23)41)18-4-8-22(16(2)12-18)38-40-24-10-6-20-26(56(46,47)48)14-28(58(52,53)54)32(36)30(20)34(24)42/h3-14,37-38H,35-36H2,1-2H3,(H,43,44,45)(H,46,47,48)(H,49,50,51)(H,52,53,54)/p-4/b39-23-,40-24- > LIRUWPZKVZZTHC-XCKRHRGHSA-J > 2.1 > 868.02333415 > C34H24N6O14S4-4 > 868.9 > CC1=C(C=CC(=C1)C2=CC(=C(C=C2)NN=C3C=CC4=C(C3=O)C(=C(C=C4S(=O)(=O)[O-])S(=O)(=O)[O-])N)C)NN=C5C=CC6=C(C5=O)C(=C(C=C6S(=O)(=O)[O-])S(=O)(=O)[O-])N > CC1=C(C=CC(=C1)C2=CC(=C(C=C2)N/N=C/3\C(=O)C4=C(C(=CC(=C4N)S(=O)(=O)[O-])S(=O)(=O)[O-])C=C3)C)N/N=C/5\C(=O)C6=C(C(=CC(=C6N)S(=O)(=O)[O-])S(=O)(=O)[O-])C=C5 > 397 > 868.02333415 > -4 > 58 > 0 > 0 > 2 > 0 > 0 > 1 > -1 > 1 5 255 > 25 27 8 25 29 8 26 28 8 26 30 8 27 31 8 28 32 8 29 35 8 30 36 8 31 33 8 32 34 8 33 35 8 34 36 8 45 51 8 45 53 8 46 52 8 46 54 8 47 49 8 47 55 8 48 50 8 48 56 8 49 51 8 50 52 8 53 55 8 54 56 8 $$$$