CDK 1030232203 23 23 0 0 0 0 0 0 0 0999 V2000 2.8579 2.0625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8579 1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5724 0.8250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1434 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5724 0.0000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1434 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2869 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8579 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4290 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2990 -1.3662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8579 -1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4290 -1.2375 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6481 -1.7280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3820 -1.5707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -1.6500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1434 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5724 -2.4751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1934 -1.1779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1434 -2.4751 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2869 -2.8876 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8579 -2.8876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0014 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4290 -2.8876 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 5 3 1 0 0 0 0 4 6 2 0 0 0 0 5 7 1 0 0 0 0 5 8 1 1 0 0 0 6 9 1 0 0 0 0 7 10 1 0 0 0 0 8 11 1 0 0 0 0 12 9 1 0 0 0 0 10 13 1 0 0 0 0 11 14 1 0 0 0 0 12 15 1 6 0 0 0 12 16 1 0 0 0 0 13 17 1 0 0 0 0 14 18 1 0 0 0 0 19 16 1 0 0 0 0 17 20 1 0 0 0 0 17 21 1 0 0 0 0 18 22 1 0 0 0 0 19 23 1 1 0 0 0 19 21 1 0 0 0 0 M END > CHEBI:227545 > Gliomasolide E > 2 > (3E,6R,8R,14R)-6,8,10-trihydroxy-14-pentyl-1-oxacyclotetradec-3-en-2-one > C18H32O5 > 328.449 > 328.22497 > 0 > O=C1O[C@@H](CCCC(O)C[C@H](C[C@@H](CC=C1)O)O)CCCCC > InChI=1S/C18H32O5/c1-2-3-4-9-17-10-5-7-14(19)12-16(21)13-15(20)8-6-11-18(22)23-17/h6,11,14-17,19-21H,2-5,7-10,12-13H2,1H3/b11-6+/t14?,15-,16-,17-/m1/s1 > CIKXQDGRSUPQKJ-AOLGVUMJSA-N $$$$