CDK 1028232204 24 28 0 0 0 0 0 0 0 0999 V2000 0.0000 -1.2375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4290 -1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -2.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1435 -1.6500 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 1.4290 -2.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -2.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1435 -2.4750 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 0.7145 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1435 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4290 -3.7126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 -2.4750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -3.7126 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 0.0000 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -4.1251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0421 -4.2646 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8860 -4.9320 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8625 -4.3509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7065 -5.0183 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0341 -5.1578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3196 -5.5703 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 3 5 2 0 0 0 0 3 6 1 0 0 0 0 4 7 2 0 0 0 0 4 8 1 0 0 0 0 5 9 1 0 0 0 0 5 10 1 0 0 0 0 6 11 1 0 0 0 0 6 12 2 0 0 0 0 7 13 1 0 0 0 0 8 14 1 0 0 0 0 8 15 2 0 0 0 0 10 16 2 0 0 0 0 11 17 1 0 0 0 0 13 18 2 0 0 0 0 19 13 1 0 0 0 0 18 20 1 0 0 0 0 19 21 1 6 0 0 0 22 19 1 0 0 0 0 21 23 2 0 0 0 0 22 24 1 6 0 0 0 7 9 1 0 0 0 0 12 16 1 0 0 0 0 15 18 1 0 0 0 0 20 22 1 0 0 0 0 23 24 1 0 0 0 0 M END > CHEBI:201261 > (3S,7R)-11-hydroxy-15-methoxy-6,8,20-trioxapentacyclo[10.8.0.02,9.03,7.014,19]icosa-1(12),2(9),4,10,14(19),15,17-heptaen-13-one > 2 > (3S,7R)-11-hydroxy-15-methoxy-6,8,20-trioxapentacyclo[10.8.0.02,9.03,7.014,19]icosa-1(12),2(9),4,10,14(19),15,17-heptaen-13-one > C18H12O6 > 324.288 > 324.06339 > 0 > O=C1C2=C(OC3=C1C(O)=CC4=C3[C@@H]5C=CO[C@@H]5O4)C=CC=C2OC > InChI=1S/C18H12O6/c1-21-10-3-2-4-11-15(10)16(20)14-9(19)7-12-13(17(14)23-11)8-5-6-22-18(8)24-12/h2-8,18-19H,1H3/t8-,18+/m0/s1 > JFHROJUPZOOWGZ-DCXZOGHSSA-N $$$$