71587428 -OEChem-03282410102D 47 44 0 1 0 0 0 0 0999 V2000 2.9511 -0.9725 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 4.2524 -3.2265 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 4.1784 -4.6388 0.0000 Mg 0 2 0 0 0 0 0 0 0 0 0 0 2.3090 -2.2326 0.0000 Mg 0 2 0 0 0 0 0 0 0 0 0 0 5.8896 -0.7786 0.0000 Mg 0 2 0 0 0 0 0 0 0 0 0 0 3.9409 1.9238 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2556 -3.8174 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6132 2.0760 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7236 -1.5792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9021 -0.6635 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9956 -2.5574 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1974 4.0323 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2099 -2.9175 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8896 0.2214 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 6.7556 -1.2786 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.4464 0.9533 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6678 -4.6265 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2601 -1.9236 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.0000 -1.2815 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.6420 -0.0214 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9215 -3.9696 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 3.5093 -3.8956 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 3.5833 -2.4834 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9190 1.7159 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.5646 -2.8664 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.6622 2.3850 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.5157 -2.5574 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.0236 0.7214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7556 -2.2786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4543 3.3632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2588 -3.2265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1100 0.3147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9466 -2.8664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4409 1.0578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2556 -3.8174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6990 2.5370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1657 -3.4674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1229 2.7999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1054 -2.3658 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1257 3.8890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8794 3.1309 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7703 -3.6082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5499 -3.7739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0740 2.4909 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3133 -1.3876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0685 4.6388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6706 -3.3324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 2 0 0 0 0 2 11 1 0 0 0 0 2 21 1 0 0 0 0 2 22 1 0 0 0 0 2 23 2 0 0 0 0 6 24 1 0 0 0 0 6 34 1 0 0 0 0 7 25 1 0 0 0 0 7 35 1 0 0 0 0 26 8 1 6 0 0 0 8 44 1 0 0 0 0 27 9 1 1 0 0 0 9 45 1 0 0 0 0 10 32 1 0 0 0 0 11 33 1 0 0 0 0 12 30 1 0 0 0 0 12 46 1 0 0 0 0 13 31 1 0 0 0 0 13 47 1 0 0 0 0 14 28 1 0 0 0 0 15 29 1 0 0 0 0 16 34 2 0 0 0 0 17 35 2 0 0 0 0 24 26 1 0 0 0 0 24 28 1 0 0 0 0 24 36 1 1 0 0 0 25 27 1 0 0 0 0 25 29 1 0 0 0 0 25 37 1 6 0 0 0 26 30 1 0 0 0 0 26 38 1 0 0 0 0 27 31 1 0 0 0 0 27 39 1 0 0 0 0 28 32 2 0 0 0 0 29 33 2 0 0 0 0 30 40 1 0 0 0 0 30 41 1 0 0 0 0 31 42 1 0 0 0 0 31 43 1 0 0 0 0 32 34 1 0 0 0 0 33 35 1 0 0 0 0 M CHG 8 3 2 4 2 5 2 14 -1 15 -1 18 -1 19 -1 21 -1 M CHG 1 22 -1 M END > 71587428 > 1 > 357 > 18 > 4 > 6 > AAADccBwPgMAACAAAAAAAAAAAAAAAQIAAAAAAAAAAAAAAAAAAAAAGgAACCAACBSggAIACAAABxCIQADQCIIAAAAgIAAACABAAEgBFAAAIAACUAAFwAALIQJAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA== > trimagnesium;[(2R)-2-[(1S)-1,2-dihydroxyethyl]-3-oxido-5-oxo-2H-furan-4-yl] phosphate > trimagnesium;[(2R)-2-[(1S)-1,2-dihydroxyethyl]-3-oxido-5-oxo-2H-furan-4-yl] phosphate > trimagnesium;[(2R)-2-[(1S)-1,2-dihydroxyethyl]-3-oxido-5-oxo-2H-furan-4-yl] phosphate > trimagnesium;[(2R)-2-[(1S)-1,2-dihydroxyethyl]-3-oxido-5-oxo-2H-furan-4-yl] phosphate > trimagnesium;[(2R)-2-[(1S)-1,2-bis(oxidanyl)ethyl]-3-oxidanidyl-5-oxidanylidene-2H-furan-4-yl] phosphate > trimagnesium;[(2R)-2-[(1S)-1,2-dihydroxyethyl]-5-keto-3-oxido-2H-furan-4-yl] phosphate > InChI=1S/2C6H9O9P.3Mg/c2*7-1-2(8)4-3(9)5(6(10)14-4)15-16(11,12)13;;;/h2*2,4,7-9H,1H2,(H2,11,12,13);;;/q;;3*+2/p-6/t2*2-,4+;;;/m00.../s1 > PBSRSWFGYPZDAU-FFIPNUABSA-H > 577.9050126 > C12H12Mg3O18P2 > 579.08 > Bypass - this structure was created from CID 71587428 > C(C(C1C(=C(C(=O)O1)OP(=O)([O-])[O-])[O-])O)O.C(C(C1C(=C(C(=O)O1)OP(=O)([O-])[O-])[O-])O)O.[Mg+2].[Mg+2].[Mg+2] > C([C@@H]([C@@H]1C(=C(C(=O)O1)OP(=O)([O-])[O-])[O-])O)O.C([C@@H]([C@@H]1C(=C(C(=O)O1)OP(=O)([O-])[O-])[O-])O)O.[Mg+2].[Mg+2].[Mg+2] > 325 > 577.9050126 > 0 > 35 > 4 > 0 > 0 > 0 > 0 > 5 > -1 > 1 5 255 > 24 36 5 25 37 6 26 8 6 27 9 5 $$$$