54670067 -OEChem-10051719083D 20 20 0 1 0 0 0 0 0999 V2000 0.0932 -1.1066 0.6445 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3436 0.0892 -1.3863 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8392 2.3901 0.2844 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8929 -0.2040 -0.3326 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0220 0.5695 -0.6056 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9915 -2.1560 -0.1376 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3397 0.2618 0.7853 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.6059 0.4585 -0.0330 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8212 1.0265 0.2887 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7464 -0.4082 0.4863 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8077 0.2273 -0.1049 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3536 -1.1481 0.1108 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5154 0.4609 1.8484 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9162 1.5092 -0.0432 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4989 -1.4735 0.4351 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0013 -0.1462 1.5179 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0999 -0.8522 -1.3986 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0039 2.6957 0.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6023 -0.7644 0.0257 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5024 -0.2572 -0.7856 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 12 1 0 0 0 0 2 8 1 0 0 0 0 2 17 1 0 0 0 0 3 9 1 0 0 0 0 3 18 1 0 0 0 0 4 10 1 0 0 0 0 4 19 1 0 0 0 0 5 11 1 0 0 0 0 5 20 1 0 0 0 0 6 12 2 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 13 1 0 0 0 0 8 10 1 0 0 0 0 8 14 1 0 0 0 0 9 11 2 0 0 0 0 10 15 1 0 0 0 0 10 16 1 0 0 0 0 11 12 1 0 0 0 0 M END > DB00126 > drugbank > PUBCHEM > https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/inchikey/CIWBSHSKHKDKBQ-JLAZNSOCSA-N/SDF?record_type=3d > [H][C@@]1(OC(=O)C(O)=C1O)[C@@H](O)CO > InChI=1S/C6H8O6/c7-1-2(8)5-3(9)4(10)6(11)12-5/h2,5,7-10H,1H2/t2-,5+/m0/s1 > CIWBSHSKHKDKBQ-JLAZNSOCSA-N > C6H8O6 > 176.1241 > 176.032087988 > 5 > 20 > -0.998558988537393 > 14.932525092170716 > 1 > 4 > 0 > 0 > (5R)-5-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxy-2,5-dihydrofuran-2-one > -1.58 > -1.9135588756666668 > 0.14 > 0 > -1 > 1 > -1 > 11.194661934216315 > 4.1599476901451 > -2.979728932431362 > 107.22 > 37.0321 > 2 > 1 > 2.45e+02 g/l > tetrahydrofolic acid > 0 $$$$