Mrv1533004231515132D 34 33 0 0 0 0 999 V2000 9.1855 6.1283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9000 5.7158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6145 6.1283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3289 5.7158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0434 6.1283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7579 5.7158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4724 6.1283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1868 5.7158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9013 6.1283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6158 5.7158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3302 6.1283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0447 5.7158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7592 6.1283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4737 5.7158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.1881 6.1283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.9026 5.7158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.6171 6.1283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.3315 5.7158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.0460 6.1283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.7605 5.7158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.4749 6.1283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.1894 5.7158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.9039 6.1283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.6184 5.7158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.3328 6.1283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.0473 5.7158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.7618 6.1283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.4762 5.7158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 29.1907 6.1283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 29.1907 6.9533 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 29.9052 5.7158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 30.6197 6.1283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 31.3341 5.7158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 32.0486 6.1283 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 19 18 1 4 0 0 0 19 20 2 0 0 0 0 21 20 1 4 0 0 0 21 22 2 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 2 0 0 0 0 29 31 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 M END > NP0145781 > NP-MRD > CCCCCCCCCCCCCCCCCCC=CC=CCCCCCCC(=O)CCCC > InChI=1S/C33H62O/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-32-33(34)31-6-4-2/h22-25H,3-21,26-32H2,1-2H3 > LHTOQMRPBOFCII-UHFFFAOYSA-N > C33H62O > 474.858 > 474.480066616 > 1 > 96 > 68.0649596083526 > 0 > 0 > 0 > 0 > tritriaconta-12,14-dien-5-one > 10.76 > 13.231430808999999 > -7.94 > 0 > 0 > 0 > -7.346980353179129 > 17.07 > 156.50980000000004 > 28 > 0 > 5.47e-06 g/l > tritriaconta-12,14-dien-5-one > 0 > NP0145781 > tritriaconta-12,14-dien-5-one $$$$