Mrv1652309092202532D 22 24 0 0 0 0 999 V2000 6.4558 4.1440 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9745 3.4739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5585 2.8391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8847 2.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5910 1.2013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9819 1.7614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1953 1.5788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0105 0.7808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2033 0.6103 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4984 0.1308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3271 0.3749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6560 -0.1650 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8359 0.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9793 0.2796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6030 1.0474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0672 1.7539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8896 1.6653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2051 0.9070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1982 2.6044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6038 3.3567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3394 3.7987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1875 3.8242 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 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 5 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 13 18 1 0 0 0 0 16 19 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 2 22 1 0 0 0 0 M END > NP0276651 > NP-MRD > OC1=CC=C2CCC(=O)OC\C=C/C3=CC=C(OC1=C2)C=C3 > InChI=1S/C18H16O4/c19-16-9-5-14-6-10-18(20)21-11-1-2-13-3-7-15(8-4-13)22-17(16)12-14/h1-5,7-9,12,19H,6,10-11H2/b2-1- > DTZHRIFDDQELBE-UPHRSURJSA-N > C18H16O4 > 296.322 > 296.104858995 > 2 > 38 > 29.615219711628647 > 1 > 1 > 0 > 1 > (13Z)-4-hydroxy-2,11-dioxatricyclo[13.2.2.1^{3,7}]icosa-1(17),3(20),4,6,13,15,18-heptaen-10-one > 3.759321662333332 > 0 > 3 > 0 > 8.428574993636436 > -3.7284628707956613 > 55.760000000000005 > 83.8306 > 0 > 1 > (13Z)-4-hydroxy-2,11-dioxatricyclo[13.2.2.1^{3,7}]icosa-1(17),3(20),4,6,13,15,18-heptaen-10-one > 0 > NP0276651 > (13z)-4-hydroxy-2,11-dioxatricyclo[13.2.2.1³,⁷]icosa-1(17),3(20),4,6,13,15,18-heptaen-10-one $$$$