Mrv1533004191520152D 27 31 0 0 0 0 999 V2000 3.2636 1.7010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3911 0.8859 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7489 0.3680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8836 0.7321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3371 0.1473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7627 0.9108 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3689 0.1858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6902 -0.5740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1938 -1.2330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6250 -1.1326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1214 -1.7915 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9475 -0.3732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4645 -0.6678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2341 -0.9650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8763 -0.4471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1539 -0.3143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8475 -0.7611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5812 -0.3839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3524 -0.6768 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8693 -0.0338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4175 0.6565 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6214 0.4401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9279 0.8869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9681 1.7110 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2746 2.1578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1941 0.5098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5750 1.0550 0.0000 C 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 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 8 13 1 0 0 0 0 5 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 3 15 1 0 0 0 0 13 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 18 22 2 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 23 26 2 0 0 0 0 16 26 1 0 0 0 0 26 27 1 0 0 0 0 6 27 1 0 0 0 0 M END > NP0318154 > NP-MRD > COC1CC2N3CC(OC(C)=O)C2(C=C1)C1=CC2=C(OCO2)C(OC)=C1C3 > InChI=1S/C20H23NO6/c1-11(22)27-17-9-21-8-13-14(7-15-19(18(13)24-3)26-10-25-15)20(17)5-4-12(23-2)6-16(20)21/h4-5,7,12,16-17H,6,8-10H2,1-3H3 > DZXAUWNEDZVVNU-UHFFFAOYSA-N > C20H23NO6 > 373.405 > 373.152537465 > 6 > 50 > 38.13367818748215 > 1 > 0 > 0 > 1 > 9,15-dimethoxy-5,7-dioxa-12-azapentacyclo[10.5.2.0¹,¹³.0²,¹⁰.0⁴,⁸]nonadeca-2,4(8),9,16-tetraen-18-yl acetate > 1.30 > 1.1092033040000002 > -2.84 > 0 > 5 > 1 > 7.429392336264568 > 66.46000000000001 > 96.7188 > 4 > 1 > 5.41e-01 g/l > 9,15-dimethoxy-5,7-dioxa-12-azapentacyclo[10.5.2.0¹,¹³.0²,¹⁰.0⁴,⁸]nonadeca-2,4(8),9,16-tetraen-18-yl acetate > 0 > NP0318154 > 9,15-dimethoxy-5,7-dioxa-12-azapentacyclo[10.5.2.0¹,¹³.0²,¹⁰.0⁴,⁸]nonadeca-2,4(8),9,16-tetraen-18-yl acetate $$$$