Mrv1533004171521042D 24 25 0 0 0 0 999 V2000 2.5559 -4.4270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2704 -4.8395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2704 -5.6645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9849 -4.4270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6993 -4.8395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6993 -5.6645 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4138 -4.4270 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1283 -4.8395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8427 -4.4270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2552 -3.7125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6677 -4.4270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3822 -4.8395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0967 -4.4270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8112 -4.8395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8112 -5.6645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5256 -6.0770 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5256 -6.9020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8112 -7.3145 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2401 -7.3145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2401 -8.1395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9546 -8.5520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5256 -8.5520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0967 -6.0770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3822 -5.6645 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 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 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 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 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 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 15 23 1 0 0 0 0 23 24 2 0 0 0 0 12 24 1 0 0 0 0 M END > NP0227980 > NP-MRD > CC(C)CC(=O)OCC1OC1C1=CC=C(OC(=O)CC(C)C)C=C1 > InChI=1S/C19H26O5/c1-12(2)9-17(20)22-11-16-19(24-16)14-5-7-15(8-6-14)23-18(21)10-13(3)4/h5-8,12-13,16,19H,9-11H2,1-4H3 > YNXFRMYLAKMNTG-UHFFFAOYSA-N > C19H26O5 > 334.412 > 334.178023937 > 3 > 50 > 36.833622135098295 > 1 > 0 > 0 > 1 > (3-{4-[(3-methylbutanoyl)oxy]phenyl}oxiran-2-yl)methyl 3-methylbutanoate > 4.18 > 4.019563338333334 > -4.45 > 0 > 2 > 0 > -4.252692490184423 > 65.13 > 89.12570000000002 > 10 > 1 > 1.19e-02 g/l > (3-{4-[(3-methylbutanoyl)oxy]phenyl}oxiran-2-yl)methyl 3-methylbutanoate > 0 > NP0227980 > (3-{4-[(3-methylbutanoyl)oxy]phenyl}oxiran-2-yl)methyl 3-methylbutanoate $$$$