448400 -OEChem-10051719563D 28 27 0 1 0 0 0 0 0999 V2000 -1.1123 1.5224 -0.0521 P 0 0 2 0 0 0 0 0 0 0 0 0 -2.1826 -1.2175 -0.0189 P 0 0 0 0 0 0 0 0 0 0 0 0 0.2486 1.1173 0.7187 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6387 0.1405 -0.7056 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6144 2.3731 -1.3350 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1280 2.2258 0.8007 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6785 -2.0943 -1.2829 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5621 -0.7537 0.6842 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1990 -1.8989 0.8859 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6416 -0.5184 0.3291 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4408 0.1888 0.9779 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2869 0.4457 0.0161 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1992 -1.8610 -0.2577 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2984 0.3302 -0.7605 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3844 -0.7077 1.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7653 1.1416 1.4157 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0734 -0.4071 1.8236 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6045 1.0791 -0.8164 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8850 -0.4878 -0.3838 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0758 -2.4440 -0.5619 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5693 -1.7433 -1.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6510 -2.4539 0.4821 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6441 0.4725 -1.6262 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2145 -0.1527 -1.1181 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5722 1.3165 -0.3718 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3747 3.3166 -1.2144 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9795 -3.0158 -1.1328 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0497 -1.3959 1.2428 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 1 4 1 0 0 0 0 1 5 1 0 0 0 0 1 6 2 0 0 0 0 2 4 1 0 0 0 0 2 7 1 0 0 0 0 2 8 1 0 0 0 0 2 9 2 0 0 0 0 3 12 1 0 0 0 0 5 26 1 0 0 0 0 7 27 1 0 0 0 0 8 28 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 10 14 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 11 17 1 0 0 0 0 12 18 1 0 0 0 0 12 19 1 0 0 0 0 13 20 1 0 0 0 0 13 21 1 0 0 0 0 13 22 1 0 0 0 0 14 23 1 0 0 0 0 14 24 1 0 0 0 0 14 25 1 0 0 0 0 M END > DB02508 > drugbank > PUBCHEM > https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/inchikey/IPFXNYPSBSIFOB-UHFFFAOYSA-N/SDF?record_type=3d > CC(C)CCO[P@](O)(=O)OP(O)(O)=O > InChI=1S/C5H14O7P2/c1-5(2)3-4-11-14(9,10)12-13(6,7)8/h5H,3-4H2,1-2H3,(H,9,10)(H2,6,7,8) > IPFXNYPSBSIFOB-UHFFFAOYSA-N > C5H14O7P2 > 248.108 > 248.021475826 > 5 > 28 > -2.4299337803520777 > 19.881370068400315 > 1 > 3 > 0 > 1 > {[hydroxy(3-methylbutoxy)phosphoryl]oxy}phosphonic acid > 0.22 > 0.5469765320000002 > -1.44 > 0 > -2 > 0 > -3 > 3.2212001821892633 > 1.779314784334345 > 113.29 > 48.4293 > 6 > 1 > 9.07e+00 g/l > tetrahydrofolic acid > 0 $$$$