439278 -OEChem-10051719403D 18 17 0 1 0 0 0 0 0999 V2000 1.7366 -0.0431 -0.0542 P 0 0 0 0 0 0 0 0 0 0 0 0 0.3633 -0.8975 -0.0306 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2786 -1.6397 -0.7381 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8137 -1.0638 -0.6971 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1558 0.0053 1.5069 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6320 1.8547 0.8297 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6403 1.2953 -0.7264 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9956 1.2017 -1.2542 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7688 -0.3383 0.6193 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.9141 -1.3420 0.6053 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1205 0.9674 -0.0606 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4862 -0.1307 1.6577 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6072 -2.2785 1.0817 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7929 -0.9409 1.1198 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0074 -2.2822 -0.6997 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7231 -0.7428 -0.8763 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9216 0.5561 1.7757 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8784 2.7021 0.4012 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 5 1 0 0 0 0 1 7 2 0 0 0 0 2 9 1 0 0 0 0 3 10 1 0 0 0 0 3 15 1 0 0 0 0 4 16 1 0 0 0 0 5 17 1 0 0 0 0 6 11 1 0 0 0 0 6 18 1 0 0 0 0 8 11 2 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 10 13 1 0 0 0 0 10 14 1 0 0 0 0 M END > DB01709 > drugbank > PUBCHEM > https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/inchikey/GXIURPTVHJPJLF-UWTATZPHSA-N/SDF?record_type=3d > OC[C@@H](OP(O)(O)=O)C(O)=O > InChI=1S/C3H7O7P/c4-1-2(3(5)6)10-11(7,8)9/h2,4H,1H2,(H,5,6)(H2,7,8,9)/t2-/m1/s1 > GXIURPTVHJPJLF-UWTATZPHSA-N > C3H7O7P > 186.0572 > 185.99293909 > 6 > 18 > -2.8203359446165748 > 13.363889103214117 > 1 > 4 > 0 > 0 > (2R)-3-hydroxy-2-(phosphonooxy)propanoic acid > -2.24 > -1.642305516 > -0.96 > 0 > -3 > 0 > -3 > 3.483549412336347 > 0.8080623457428864 > -3.0640832510433764 > 124.29000000000002 > 31.2564 > 4 > 1 > 2.03e+01 g/l > biotin > 0 $$$$