Mrv1652309122214032D 24 25 0 0 1 0 999 V2000 0.7145 9.2411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 8.4161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 8.0036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0000 8.0036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0000 7.1786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 6.7661 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 5.9411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 5.5286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 4.7036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 4.2911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 3.4661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3819 2.9812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1665 3.2361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7796 2.6841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5642 2.9390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6081 1.8771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1270 2.1965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6119 1.5291 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3020 2.1965 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1830 1.5291 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 2.9812 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7376 3.2361 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 4.7036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0000 5.5286 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 2 4 2 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 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 2 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 14 16 1 0 0 0 0 12 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 11 21 1 0 0 0 0 21 22 1 6 0 0 0 10 23 1 0 0 0 0 23 24 2 0 0 0 0 7 24 1 0 0 0 0 M END > NP0328518 > NP-MRD > CC(C)CC1=C([C@@H](O)N(O)C1=O)C1=CC=C(OCC=C(C)C)C=C1 > InChI=1S/C19H25NO4/c1-12(2)9-10-24-15-7-5-14(6-8-15)17-16(11-13(3)4)18(21)20(23)19(17)22/h5-9,13,19,22-23H,10-11H2,1-4H3/t19-/m1/s1 > RXXXEUDUCIPSLZ-LJQANCHMSA-N > C19H25NO4 > 331.412 > 331.178358289 > 4 > 49 > 37.041385359745135 > 1 > 2 > 0 > 1 > (5R)-1,5-dihydroxy-4-{4-[(3-methylbut-2-en-1-yl)oxy]phenyl}-3-(2-methylpropyl)-2,5-dihydro-1H-pyrrol-2-one > 3.4978962996666665 > 0 > 2 > 0 > 12.834459275197204 > 7.554564177902446 > -4.045034809445435 > 70.0 > 94.05779999999999 > 6 > 1 > (5R)-1,5-dihydroxy-4-{4-[(3-methylbut-2-en-1-yl)oxy]phenyl}-3-(2-methylpropyl)-5H-pyrrol-2-one > 0 > NP0328518 > (5r)-1,5-dihydroxy-4-{4-[(3-methylbut-2-en-1-yl)oxy]phenyl}-3-(2-methylpropyl)-5h-pyrrol-2-one $$$$