Mrv1652309122217202D 32 34 0 0 0 0 999 V2000 2.4915 1.8532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0268 0.8399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2473 0.5698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6236 1.1099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1559 0.8399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3118 0.0297 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0914 -0.2403 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7796 1.3800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5591 1.1099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6236 2.1901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2473 2.7302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1559 2.4601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4768 3.2201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0506 3.9265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4493 4.6488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 5.3552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2741 4.6648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2988 3.1498 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4776 2.4626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2459 2.0253 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7796 1.9200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5591 2.1901 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7150 3.0002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 3.5403 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4946 3.2703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1182 2.7302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9623 1.9200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1827 1.6500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5859 1.3800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3655 1.6500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4300 0.5698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6505 0.2998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 4 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 5 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 2 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 13 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 4 21 1 0 0 0 0 12 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 25 23 1 4 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 31 32 1 0 0 0 0 2 32 1 0 0 0 0 M END > NP0330206 > NP-MRD > CC(C)CC1N=C(O)C23OC(=O)C=CC(O)C(O)CCC(C)=CC2C(OO)C(C)=C(C)C13 > InChI=1S/C24H35NO7/c1-12(2)10-17-21-14(4)15(5)22(32-30)16-11-13(3)6-7-18(26)19(27)8-9-20(28)31-24(16,21)23(29)25-17/h8-9,11-12,16-19,21-22,26-27,30H,6-7,10H2,1-5H3,(H,25,29) > TWCFECMVQLODGL-UHFFFAOYSA-N > C24H35NO7 > 449.544 > 449.241352471 > 7 > 67 > 47.82663434672406 > 1 > 4 > 0 > 1 > 11-hydroperoxy-5,6,16-trihydroxy-9,12,13-trimethyl-14-(2-methylpropyl)-2H,5H,6H,7H,8H,11H,13aH,14H,16bH-oxacyclododeca[3,2-e]isoindol-2-one > 1.428429898721153 > 0 > 3 > 0 > 11.703118100282166 > 1.774460754867221 > 4.700768480468165 > 128.81 > 120.04229999999997 > 3 > 1 > 11-hydroperoxy-5,6,16-trihydroxy-9,12,13-trimethyl-14-(2-methylpropyl)-5H,6H,7H,8H,11H,13aH,14H,16bH-oxacyclododeca[3,2-e]isoindol-2-one > 0 > NP0330206 > 11-hydroperoxy-5,6,16-trihydroxy-9,12,13-trimethyl-14-(2-methylpropyl)-5h,6h,7h,8h,10ah,11h,13ah,14h-oxacyclododeca[2,3-d]isoindol-2-one $$$$