8150 -OEChem-10051720053D 23 22 0 0 0 0 0 0 0999 V2000 -0.0007 0.2852 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5667 -0.4091 0.0147 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5664 -0.4091 -0.0147 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1752 -0.5153 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1749 -0.5146 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3909 0.3912 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3909 0.3915 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7410 0.3903 -0.0086 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7409 0.3899 0.0085 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1932 -1.1618 0.8838 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1910 -1.1627 -0.8871 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1934 -1.1612 -0.8837 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1911 -1.1623 0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3690 1.0488 0.8735 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3798 1.0277 -0.8972 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3692 1.0491 -0.8735 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3800 1.0280 0.8973 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6097 -0.2732 0.0102 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7796 1.0410 0.8705 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7791 0.9896 -0.9234 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7794 0.9892 0.9233 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6095 -0.2738 -0.0102 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7797 1.0407 -0.8705 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 1 5 1 0 0 0 0 2 6 1 0 0 0 0 2 8 1 0 0 0 0 3 7 1 0 0 0 0 3 9 1 0 0 0 0 4 6 1 0 0 0 0 4 10 1 0 0 0 0 4 11 1 0 0 0 0 5 7 1 0 0 0 0 5 12 1 0 0 0 0 5 13 1 0 0 0 0 6 14 1 0 0 0 0 6 15 1 0 0 0 0 7 16 1 0 0 0 0 7 17 1 0 0 0 0 8 18 1 0 0 0 0 8 19 1 0 0 0 0 8 20 1 0 0 0 0 9 21 1 0 0 0 0 9 22 1 0 0 0 0 9 23 1 0 0 0 0 M END > DB02935 > drugbank > PUBCHEM > https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/inchikey/SBZXBUIDTXKZTM-UHFFFAOYSA-N/SDF?record_type=3d > COCCOCCOC > InChI=1S/C6H14O3/c1-7-3-5-9-6-4-8-2/h3-6H2,1-2H3 > SBZXBUIDTXKZTM-UHFFFAOYSA-N > C6H14O3 > 134.1736 > 134.094294314 > 3 > 23 > 3.1424327124312725e-11 > 15.501249159118979 > 1 > 0 > 0 > 0 > 1-methoxy-2-(2-methoxyethoxy)ethane > 0.12 > 0.030598418333333724 > -0.34 > 0 > 0 > 0 > 0 > -3.6520117010253097 > 27.69 > 35.09949999999999 > 6 > 1 > 6.09e+01 g/l > biotin > 1 $$$$