Ketcher 11172218442D 1 1.00000 0.00000 0 44 49 0 1 0 999 V2000 13.9586 -6.0984 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0309 -11.0982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8247 -9.5982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1647 -7.5983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6908 -9.0983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2987 -8.0983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9586 -8.0983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0309 -9.0983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6286 -10.5982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3609 -6.5983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0924 -10.5982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8971 -6.5983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9586 -9.0983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0309 -8.0983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6908 -8.0983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2987 -9.0983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4947 -11.0982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4947 -6.0984 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6286 -9.5982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3609 -7.5983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2270 -11.0982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7625 -6.0984 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0924 -9.5982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8971 -7.5983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8247 -7.5983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1647 -9.5982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3609 -10.5982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6286 -6.5983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4947 -9.0983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4947 -8.0983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3609 -9.5982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6286 -7.5983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5570 -7.5983 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4325 -9.5982 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4947 -12.0982 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4947 -5.0984 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7625 -9.0983 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2270 -8.0983 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2270 -12.0982 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7625 -5.0984 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.8247 -6.5983 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1647 -10.5982 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2270 -9.0983 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7625 -8.0983 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 41 1 0 0 0 2 42 1 0 0 0 3 5 2 0 0 0 3 13 1 0 0 0 4 6 2 0 0 0 4 14 1 0 0 0 5 15 1 0 0 0 6 16 1 0 0 0 7 13 2 0 0 0 7 25 1 0 0 0 8 14 2 0 0 0 8 26 1 0 0 0 17 9 1 1 0 0 9 19 2 0 0 0 18 10 1 1 0 0 10 20 2 0 0 0 11 21 1 0 0 0 11 23 2 0 0 0 12 22 1 0 0 0 12 24 2 0 0 0 13 23 1 0 0 0 14 24 1 0 0 0 15 25 2 0 0 0 15 33 1 0 0 0 16 26 2 0 0 0 16 34 1 0 0 0 17 27 2 0 0 0 17 35 1 0 0 0 18 28 2 0 0 0 18 36 1 0 0 0 29 19 1 1 0 0 19 37 1 0 0 0 30 20 1 1 0 0 20 38 1 0 0 0 21 27 1 0 0 0 21 39 2 0 0 0 22 28 1 0 0 0 22 40 2 0 0 0 23 43 1 0 0 0 24 44 1 0 0 0 25 41 1 0 0 0 26 42 1 0 0 0 27 31 1 0 0 0 28 32 1 0 0 0 29 30 1 0 0 0 29 31 2 0 0 0 30 32 2 0 0 0 31 43 1 0 0 0 32 44 1 0 0 0 M END > CHEBI:194123 > (aR)-3',3"'-dimethoxycupressuflavone > 2 > C32H22O12 > 598.516 > 598.11113 > 0 > COC=1C=C(C=CC1O)C2=CC(C3=C(C=C(C(C=4C(=CC(=C5C(C=C(C=6C=CC(=C(C6)OC)O)OC54)=O)O)O)=C3O2)O)O)=O > InChI=1S/C32H22O12/c1-41-25-7-13(3-5-15(25)33)23-11-21(39)27-17(35)9-19(37)29(31(27)43-23)30-20(38)10-18(36)28-22(40)12-24(44-32(28)30)14-4-6-16(34)26(8-14)42-2/h3-12,33-38H,1-2H3 > NEIVLPWQGIRUHB-UHFFFAOYSA-N $$$$