Marvin 08021012002D 44 46 0 0 1 0 999 V2000 6.6281 -3.5456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6281 -2.7206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1991 -3.5456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1991 -2.7206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4847 -3.9579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4847 -2.3081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7703 -2.7206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7703 -3.5456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0570 -3.5456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3425 -3.9579 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3425 -2.3081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3425 -1.4830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7715 -3.9579 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0570 -2.7206 0.0000 N 0 5 0 0 0 0 0 0 0 0 0 0 5.9135 -3.9579 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9135 -4.7829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6281 -5.1955 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.6281 -6.0205 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.3425 -4.7829 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3425 -6.4330 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.9135 -6.4330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3425 -7.2580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0570 -6.0205 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0570 -7.6705 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0557 -3.9579 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9135 -2.3081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7763 -7.2550 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 9.4909 -7.6674 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2053 -7.2549 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.9198 -7.6672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6342 -7.2546 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.9199 -8.4922 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2052 -6.4299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7763 -6.4300 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5676 -8.0502 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 13.0632 -7.2546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3487 -8.4921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7777 -7.6671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6342 -8.9045 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0632 -8.9045 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 14.4921 -7.2546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2065 -7.6671 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 14.4921 -6.4296 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3487 -7.6671 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 15 3 1 0 0 0 0 15 1 1 0 0 0 0 4 26 1 0 0 0 0 26 2 2 0 0 0 0 10 1 2 0 0 0 0 2 1 1 0 0 0 0 2 11 1 0 0 0 0 10 9 1 0 0 0 0 11 14 1 0 0 0 0 14 9 1 0 0 0 0 5 3 2 0 0 0 0 3 4 1 0 0 0 0 6 4 2 0 0 0 0 5 8 1 0 0 0 0 8 7 2 0 0 0 0 7 6 1 0 0 0 0 9 13 2 0 0 0 0 11 12 2 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 6 0 0 0 18 20 1 0 0 0 0 18 21 1 1 0 0 0 20 22 1 0 0 0 0 20 23 1 6 0 0 0 22 24 1 0 0 0 0 8 25 1 0 0 0 0 24 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 32 2 0 0 0 0 29 33 1 1 0 0 0 27 34 2 0 0 0 0 27 35 1 0 0 0 0 44 31 1 0 0 0 0 44 36 1 0 0 0 0 44 37 1 1 0 0 0 36 38 1 0 0 0 0 37 39 2 0 0 0 0 37 40 1 0 0 0 0 38 41 1 0 0 0 0 41 42 1 0 0 0 0 41 43 2 0 0 0 0 M CHG 4 14 -1 35 -1 40 -1 42 -1 M END > CHEBI:59920 > coenzyme F420-1(4-) > The tetraanion of coenzyme F420-1 arising from deprotonation of the carboxylic acid and phosphate functions as well as the 3-position on the pyrimidinoquinoline ring system; major species at pH 7.3. > 3 > oxidized coenzyme F420-1; coenzyme F420-1 tetraanion > 1-deoxy-5-O-({[(2S)-1-{[(1S)-1,3-dicarboxylatopropyl]amino}-1-oxopropan-2-yl]oxy}phosphinato)-1-(8-hydroxy-2,4-dioxo-3,4-dihydropyrimido[4,5-b]quinolin-3-id-10(4H)-yl)-D-ribitol > C24H25N4O15P > 640.44690 > 640.10760 > -4 > C[C@H](OP([O-])(=O)OC[C@@H](O)[C@@H](O)[C@@H](O)Cn1c2cc(O)ccc2cc2c1nc(=O)[n-]c2=O)C(=O)N[C@@H](CCC([O-])=O)C([O-])=O > InChI=1S/C24H29N4O15P/c1-10(21(35)25-14(23(37)38)4-5-18(32)33)43-44(40,41)42-9-17(31)19(34)16(30)8-28-15-7-12(29)3-2-11(15)6-13-20(28)26-24(39)27-22(13)36/h2-3,6-7,10,14,16-17,19,30-31,34H,4-5,8-9H2,1H3,(H6,25,26,27,29,32,33,35,36,37,38,39,40,41)/p-4/t10-,14-,16-,17+,19-/m0/s1 > VXLZCIMPZIERNZ-LADHFWMSSA-J $$$$