Mrv1652309112200572D 25 28 0 0 1 0 999 V2000 6.4435 1.0079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9909 0.3182 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1672 0.3654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7145 -0.3244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8909 -0.2772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5199 0.4596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9726 1.1494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7962 1.1022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2489 1.7920 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6962 0.5068 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1801 1.1504 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4085 0.8585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4477 0.0344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7537 -0.4116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0204 -0.0335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6736 -0.4795 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0188 0.7906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7521 1.1687 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4461 0.7227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6753 1.2366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6361 2.0606 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3301 2.5066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2436 -0.1829 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.6146 -0.9198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4382 -0.9670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 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 3 8 1 0 0 0 0 8 9 1 0 0 0 0 6 10 1 0 0 0 0 10 11 1 1 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 17 20 2 0 0 0 0 12 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 23 13 1 1 0 0 0 10 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 5 25 1 0 0 0 0 M END > NP0306475 > NP-MRD > COC1=CC2=C(C=C1O)[C@@H]1OC3=C(C=C(O)C(OC)=C3OC)[C@@H]1CO2 > InChI=1S/C18H18O7/c1-21-14-6-13-9(5-11(14)19)15-10(7-24-13)8-4-12(20)17(22-2)18(23-3)16(8)25-15/h4-6,10,15,19-20H,7H2,1-3H3/t10-,15-/m0/s1 > RJKDCHOJONROOJ-BONVTDFDSA-N > C18H18O7 > 346.335 > 346.10525292 > 7 > 43 > 35.706938233397175 > 1 > 2 > 0 > 1 > (1R,10R)-5,14,15-trimethoxy-8,17-dioxatetracyclo[8.7.0.0^{2,7}.0^{11,16}]heptadeca-2(7),3,5,11(16),12,14-hexaene-4,13-diol > 1.8903155433333336 > 0 > 4 > 0 > 10.608964925979716 > 9.987767690382247 > -4.231084292688226 > 86.61000000000001 > 87.96840000000002 > 3 > 1 > (1R,10R)-5,14,15-trimethoxy-8,17-dioxatetracyclo[8.7.0.0^{2,7}.0^{11,16}]heptadeca-2(7),3,5,11(16),12,14-hexaene-4,13-diol > 0 > NP0306475 > (1r,10r)-5,14,15-trimethoxy-8,17-dioxatetracyclo[8.7.0.0²,⁷.0¹¹,¹⁶]heptadeca-2(7),3,5,11(16),12,14-hexaene-4,13-diol $$$$