Ketcher 07292010362D 1 1.00000 0.00000 0 43 46 0 0 0 999 V2000 2.2177 -1.6156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9087 -2.5668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2177 -1.6156 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5268 -2.5668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4778 -2.8758 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7177 -3.1545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3161 1.3093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3988 0.1069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4206 0.3148 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2297 1.7160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4376 2.6942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8988 0.9728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8933 1.0775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3000 1.9909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4501 1.8093 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9935 -2.5668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3024 -1.6156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3024 -1.6156 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6114 -2.5668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5625 -2.8758 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8024 -3.1545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8024 -4.1545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6685 -4.6545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8024 -6.1545 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6685 -5.6545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5344 -6.1545 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0423 -2.8758 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4835 0.1069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9835 0.9728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9779 1.0775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3143 1.7160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5223 2.6942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4733 3.0031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5053 0.3148 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4007 1.3093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5348 1.8093 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8056 -0.8067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8902 -0.8067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7177 -4.1545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5838 -4.6545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4497 -6.1545 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5838 -5.6545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7177 -6.1545 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 37 1 1 0 0 0 1 3 1 0 0 0 1 4 2 0 0 0 6 2 2 0 0 0 3 2 1 0 0 0 2 27 1 0 0 0 4 6 1 0 0 0 4 5 1 0 0 0 6 39 1 0 0 0 15 7 2 0 0 0 7 9 1 0 0 0 10 7 1 0 0 0 8 37 2 0 0 0 9 8 1 0 0 0 12 8 1 0 0 0 10 12 2 0 0 0 10 11 1 0 0 0 12 13 1 0 0 0 13 14 2 0 0 0 16 27 2 0 0 0 18 16 1 0 0 0 21 16 1 0 0 0 38 17 1 0 0 0 18 17 2 0 0 0 19 17 1 0 0 0 19 21 2 0 0 0 19 20 1 0 0 0 21 22 1 0 0 0 22 23 1 0 0 0 23 25 1 0 0 0 25 24 1 0 0 0 25 26 2 0 0 0 28 34 1 0 0 0 29 28 1 0 0 0 38 28 2 0 0 0 31 29 2 0 0 0 29 30 1 0 0 0 31 35 1 0 0 0 31 32 1 0 0 0 32 33 2 0 0 0 34 35 1 0 0 0 35 36 2 0 0 0 39 40 1 0 0 0 40 42 1 0 0 0 42 41 1 0 0 0 42 43 2 0 0 0 M CHG 2 24 -1 41 -1 M END > CHEBI:57991 > biliverdin(2-) > Dicarboxylate anion of biliverdin; major species at pH 7.3. > 3 > biliverdin IX-alpha; biliverdin dianion > C33H32N4O6 > 580.642 > 580.23328 > -2 > C=1(/C=C/2\NC(=O)C(=C2C=C)C)NC(=C(C1C)CCC([O-])=O)/C=C/3\N=C(/C=C/4\NC(C(=C4C)C=C)=O)C(=C3CCC([O-])=O)C > InChI=1S/C33H34N4O6/c1-7-20-19(6)32(42)37-27(20)14-25-18(5)23(10-12-31(40)41)29(35-25)15-28-22(9-11-30(38)39)17(4)24(34-28)13-26-16(3)21(8-2)33(43)36-26/h7-8,13-15,35H,1-2,9-12H2,3-6H3,(H,36,43)(H,37,42)(H,38,39)(H,40,41)/p-2/b26-13-,27-14-,28-15- > QBUVFDKTZJNUPP-BBROENKCSA-L $$$$