Mrv0541 02241221332D 34 33 0 0 0 0 999 V2000 17.8480 -11.1296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5625 -10.7171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2770 -11.1296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.9914 -10.7171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7059 -11.1296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.4204 -10.7171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.1349 -11.1296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.8493 -10.7171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.5638 -11.1296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.2783 -10.7171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.9927 -11.1296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.7072 -10.7171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.4217 -11.1296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.1362 -10.7171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.8506 -11.1296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.5651 -10.7171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 29.2796 -11.1296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 29.9940 -10.7171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 30.7085 -11.1296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 31.4230 -10.7171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 32.1374 -11.1296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 32.8519 -10.7171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 33.5664 -11.1296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 34.2809 -10.7171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 34.9953 -11.1296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 35.7098 -10.7171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 36.4243 -11.1296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 37.1387 -10.7171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 37.8532 -11.1296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 38.5677 -10.7171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 39.2822 -11.1296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 39.9966 -10.7171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 39.9966 -9.8921 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 40.7111 -11.1296 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 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 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 32 33 2 0 0 0 0 32 34 1 0 0 0 0 M END > NP0047070 > NP-MRD > CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(C)=O > InChI=1S/C33H66O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33(2)34/h3-32H2,1-2H3 > NJPSQBXYMKTWBI-UHFFFAOYSA-N > C33H66O > 478.8765 > 478.511366734 > 1 > 69.83687967487192 > 0 > 0 > 0 > 0 > tritriacontan-2-one > 10.77 > 13.699306940333333 > -7.70 > 0 > 0 > 0 > 19.64344776069631 > -7.270866249933757 > 17.07 > 154.2507 > 30 > 0 > 9.59e-06 g/l > tritriacontan-2-one > 0 > NP0047070 > Tritriacontanone $$$$