Mrv1533004161523222D 31 35 0 0 0 0 999 V2000 0.2154 -1.1602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4649 -0.3739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0913 0.2354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1582 1.0218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9640 1.1989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0237 2.0946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2101 1.9576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7022 2.8544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7137 2.6014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 2.0793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9088 1.3960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5202 0.5896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3260 0.7666 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8822 0.1573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6327 -0.6290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8269 -0.8061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2707 -0.1968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0211 -0.9831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1889 -1.2383 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9394 -2.0247 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9947 -1.0613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2442 -0.2749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9956 0.0658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7129 -0.3418 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9037 0.8856 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0956 1.0516 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6880 0.3344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7218 3.4264 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4403 3.8318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4484 4.6568 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1507 3.4123 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 6 8 1 0 0 0 0 6 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 5 12 1 0 0 0 0 12 13 1 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 16 17 1 0 0 0 0 2 17 1 0 0 0 0 12 17 1 0 0 0 0 17 18 1 0 0 0 0 15 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 2 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 23 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 14 27 1 0 0 0 0 22 27 2 0 0 0 0 9 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 M END > NP0282979 > NP-MRD > CC1CCC2C(C)(C)C(CCC22OC3=C(CC12C)C(O)=CC1=C3CNC1=O)OC(C)=O > InChI=1S/C25H33NO5/c1-13-6-7-19-23(3,4)20(30-14(2)27)8-9-25(19)24(13,5)11-16-18(28)10-15-17(21(16)31-25)12-26-22(15)29/h10,13,19-20,28H,6-9,11-12H2,1-5H3,(H,26,29) > PYXJLZDIRGAZQG-UHFFFAOYSA-N > C25H33NO5 > 427.541 > 427.235873167 > 4 > 64 > 47.0418284069364 > 1 > 2 > 0 > 1 > 10-hydroxy-13,14,18,18-tetramethyl-7-oxo-2-oxa-6-azapentacyclo[11.8.0.0¹,¹⁷.0³,¹¹.0⁴,⁸]henicosa-3(11),4(8),9-trien-19-yl acetate > 4.51 > 3.7182382276666655 > -4.77 > 0 > 5 > 0 > 14.388007520013982 > 9.061411760314794 > -1.3332004303149727 > 84.86000000000001 > 116.22559999999996 > 2 > 1 > 7.26e-03 g/l > 10-hydroxy-13,14,18,18-tetramethyl-7-oxo-2-oxa-6-azapentacyclo[11.8.0.0¹,¹⁷.0³,¹¹.0⁴,⁸]henicosa-3(11),4(8),9-trien-19-yl acetate > 0 > NP0282979 > 7,10-dihydroxy-13,14,18,18-tetramethyl-2-oxa-6-azapentacyclo[11.8.0.0¹,¹⁷.0³,¹¹.0⁴,⁸]henicosa-3(11),4(8),6,9-tetraen-19-yl acetate $$$$