Mrv1533004151516422D 31 31 0 0 0 0 999 V2000 7.2406 -0.3974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8643 -0.9375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6438 -0.6674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2674 -1.2075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0470 -0.9375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6706 -1.4776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4502 -1.2075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0738 -1.7476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8534 -1.4776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4770 -2.0177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2566 -1.7476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8802 -2.2877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6598 -2.0177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8157 -1.2075 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.1920 -0.6674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4125 -0.9375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.3479 0.1427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2834 -2.5578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7554 -1.8811 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.5773 -1.9514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0493 -1.2748 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.1411 -2.5538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0057 -2.9564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7528 -2.6063 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.4294 -3.0783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3591 -3.9003 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.1765 -2.7282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8498 -3.7665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0311 -3.8686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6811 -3.1215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8710 -2.9656 0.0000 O 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 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 11 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 2 0 0 0 0 15 17 1 0 0 0 0 13 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 18 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 23 28 1 0 0 0 0 28 29 2 0 0 0 0 29 30 1 0 0 0 0 18 30 1 0 0 0 0 30 31 2 0 0 0 0 M END > NP0159360 > NP-MRD > CCCCCCCCCCCCC(OC(C)=O)C1(OC(C)=O)C(OC(C)=O)C=CC1=O > InChI=1S/C24H38O7/c1-5-6-7-8-9-10-11-12-13-14-15-22(29-18(2)25)24(31-20(4)27)21(28)16-17-23(24)30-19(3)26/h16-17,22-23H,5-15H2,1-4H3 > HELIJCZATUDERA-UHFFFAOYSA-N > C24H38O7 > 438.561 > 438.261753564 > 4 > 69 > 50.06291307544116 > 0 > 0 > 0 > 1 > 1-[1,2-bis(acetyloxy)-5-oxocyclopent-3-en-1-yl]tridecyl acetate > 5.29 > 5.345403241666666 > -6.40 > 0 > 1 > 0 > 9.969771954924912 > -6.424045756204126 > 95.97 > 116.10369999999999 > 18 > 0 > 1.73e-04 g/l > 1-[1,2-bis(acetyloxy)-5-oxocyclopent-3-en-1-yl]tridecyl acetate > 0 > NP0159360 > 1-[1,2-bis(acetyloxy)-5-oxocyclopent-3-en-1-yl]tridecyl acetate $$$$