263 -OEChem-02040815572D 15 14 0 0 0 0 0 0 0999 V2000 2.5369 0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6675 0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8705 0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7365 -0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5335 -0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0044 -0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8015 -0.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3110 -0.2869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5380 0.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6910 0.7869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 1 15 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 2 7 1 0 0 0 0 3 5 1 0 0 0 0 3 8 1 0 0 0 0 3 9 1 0 0 0 0 4 10 1 0 0 0 0 4 11 1 0 0 0 0 5 12 1 0 0 0 0 5 13 1 0 0 0 0 5 14 1 0 0 0 0 M END > 1 > 263 > 1 > 13.1 > 1 > 1 > 2 > AAADccBgIAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAGgAACAAACACggAICAAAAAgAAAAAAAAAAAAAAAAAAAAAAAAAAEAAAAAAAQAAEAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA== > butan-1-ol > butan-1-ol > butan-1-ol > butan-1-ol > butan-1-ol > InChI=1/C4H10O/c1-2-3-4-5/h5H,2-4H2,1H3 > 0.9 > 74.073165 > C4H10O > 74.1216 > CCCCO > CCCCO > 20.2 > 74.073165 > 0 > 5 > 0 > 0 > 0 > 0 > 0 > 1 > 1 > 12075283 > 1 > ZINC > ZINC01530354 > Acros Organics 10769 Acros Organics 16769 Acros Organics 17474 Acros Organics 23208 Acros Organics 30066 Acros Organics 32134 Acros Organics 42349 Acros Organics 61002 Acros Organics 61025 Alfa-Aesar 22925 Alfa-Aesar 31068 Alfa-Aesar 32443 Alfa-Aesar 33496 Alfa-Aesar 36570 Alfa-Aesar 40816 Alfa-Aesar 41867 Alfa-Aesar 43295 Alfa-Aesar 44209 Alfa-Aesar 87754 Alfa-Aesar 88718 Alfa-Aesar L13171 Alfa-Aesar L19920 > 71-36-3 ZINC01530354 > 71-36-3 > ZINC01530354 > http://zinc.docking.org/ > http://zinc.docking.org/srchdb.pl?zinc=1530354 > 263 1 $$$$