13 12 0 0001 0 0 0 0 0999 V2000 5.7610 -1.9930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 4.6072 -1.3313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 3.4614 -1.9930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 2.3076 -1.3313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 1.1538 -1.9930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 6.9148 -1.3313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 4.6072 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 3.4614 -3.3243 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 2.3076 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0.0000 -1.3313 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 8.0686 -1.9930 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 5.7610 -3.3243 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 6.9148 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 1 6 1 0 1 12 1 6 2 3 1 0 2 7 1 6 3 4 1 0 3 8 1 1 4 5 1 0 4 9 1 1 5 10 1 0 6 11 1 0 6 13 2 0 M CHG 1 11 -1 M END > InChI=1S/C6H12O7/c7-1-2(8)3(9)4(10)5(11)6(12)13/h2-5,7-11H,1H2,(H,12,13)/p-1/t2-,3+,4+,5-/m1/s1 > RGHNJXZEOKUKBD-MGCNEYSASA-M > 1/1/N:5,4,3,2,1,6,10,9,8,7,12,11,13/E:(12,13)/it:im/rA:13cCCCCCCOOOOO-OO/rB:s1;s2;s3;s4;s1;N2;P3;P4;s5;s6;N1;d6;/rC:5.761,-1.993,0;4.6072,-1.3313,0;3.4614,-1.993,0;2.3076,-1.3313,0;1.1538,-1.993,0;6.9148,-1.3313,0;4.6072,0,0;3.4614,-3.3243,0;2.3076,0,0;0,-1.3313,0;8.0686,-1.993,0;5.761,-3.3243,0;6.9148,0,0; > C6 H11 O7 > 195.1473 > [C@H](O)(C(=O)[O-])[C@@H](O)[C@@H](O)[C@H](O)CO > 4574468 $$$$