2724898 -OEChem-10051720073D 25 24 0 1 0 0 0 0 0999 V2000 1.7646 -1.6777 0.1495 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8213 -0.3232 -0.2606 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0869 0.3754 0.2421 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4366 0.3119 0.3377 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3426 -0.2299 -0.3855 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7469 -0.2909 -0.1903 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.6042 0.4390 0.1366 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9731 0.4019 0.3456 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9339 0.9935 -0.3749 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8631 -1.3877 -0.0016 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7770 -0.2572 -1.3545 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0386 1.4448 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1424 0.2906 1.3343 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3961 0.1916 1.4286 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4287 1.3902 0.1328 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3025 -0.1233 -1.4758 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3886 -1.3029 -0.1657 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -0.2326 -1.2858 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6910 0.3205 1.2214 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6047 1.5091 -0.0937 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4896 -0.0085 -0.3259 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0841 0.4058 1.4283 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5924 -2.0549 -0.1946 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7814 1.4604 0.1144 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8890 1.0207 -1.4579 H 0 0 0 0 0 0 0 0 0 0 0 0 1 6 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 10 1 0 0 0 0 2 11 1 0 0 0 0 3 5 1 0 0 0 0 3 12 1 0 0 0 0 3 13 1 0 0 0 0 4 6 1 0 0 0 0 4 14 1 0 0 0 0 4 15 1 0 0 0 0 5 7 1 0 0 0 0 5 16 1 0 0 0 0 5 17 1 0 0 0 0 6 8 1 0 0 0 0 6 18 1 0 0 0 0 7 19 1 0 0 0 0 7 20 1 0 0 0 0 7 21 1 0 0 0 0 8 9 2 0 0 0 0 8 22 1 0 0 0 0 9 24 1 0 0 0 0 9 25 1 0 0 0 0 M END > DB03025 > drugbank > PUBCHEM > https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/inchikey/VSMOENVRRABVKN-MRVPVSSYSA-N/SDF?record_type=3d > CCCCC[C@H](O)C=C > InChI=1S/C8H16O/c1-3-5-6-7-8(9)4-2/h4,8-9H,2-3,5-7H2,1H3/t8-/m1/s1 > VSMOENVRRABVKN-MRVPVSSYSA-N > C8H16O > 128.212 > 128.120115134 > 1 > 25 > 1.9141409096766397e-09 > 16.251503382471107 > 1 > 1 > 0 > 0 > (3S)-oct-1-en-3-ol > 2.43 > 2.4854761693333334 > -1.99 > 0 > 0 > 0 > 0 > 17.487640160517568 > -1.7107061937896155 > 20.23 > 40.169799999999995 > 5 > 1 > 1.31e+00 g/l > tetrahydrofolic acid > 1 $$$$