Mrv1652309122214142D 21 23 0 0 1 0 999 V2000 0.0000 -4.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -4.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 -3.7125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -3.7125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -2.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 -2.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1434 -2.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 -1.6500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7145 -1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -1.6500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1434 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1434 0.4125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8579 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5724 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5724 -1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8579 -1.6500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.8579 -2.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1434 -1.2375 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1434 -2.0625 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 2 4 1 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 8 6 1 1 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 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 13 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 6 0 0 0 18 20 1 0 0 0 0 8 20 1 0 0 0 0 13 20 1 0 0 0 0 20 21 1 6 0 0 0 M END > NP0328617 > NP-MRD > C[C@H]1CCC2OC22C=CC(=O)[C@H](\C(C)=C\OC(C)=O)[C@]12C > InChI=1S/C17H22O4/c1-10(9-20-12(3)18)15-13(19)7-8-17-14(21-17)6-5-11(2)16(15,17)4/h7-9,11,14-15H,5-6H2,1-4H3/b10-9+/t11-,14?,15-,16-,17?/m0/s1 > QKGMLVZVDHLJMV-MNDXUOKNSA-N > C17H22O4 > 290.359 > 290.151809188 > 3 > 43 > 30.759980270966743 > 1 > 0 > 0 > 1 > (1E)-2-[(4S,4aS,5R)-4,4a-dimethyl-6-oxo-2H,3H,4H,4aH,5H,6H,8bH-naphtho[4,4a-b]oxiren-5-yl]prop-1-en-1-yl acetate > 2.4032833046666666 > 0 > 3 > 0 > 14.61582778790136 > -4.2558400709110575 > 55.900000000000006 > 78.7177 > 3 > 1 > (1E)-2-[(4S,4aS,5R)-4,4a-dimethyl-6-oxo-2H,3H,4H,5H,8bH-naphtho[4,4a-b]oxiren-5-yl]prop-1-en-1-yl acetate > 0 > NP0328617 > (1e)-2-[(4s,4as,5r)-4,4a-dimethyl-6-oxo-1ah,2h,3h,4h,5h-naphtho[4,4a-b]oxiren-5-yl]prop-1-en-1-yl acetate $$$$