Mrv0541 02241208592D 43 47 0 0 0 0 999 V2000 6.4277 1.6501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4277 0.8251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7126 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7126 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9989 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2839 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2839 -1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4277 0.0001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1427 0.4125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9989 1.6501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9989 0.8251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2839 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5702 0.8251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8552 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8552 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5702 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5702 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8552 -2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1402 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1402 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1402 0.0001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2433 2.6951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7126 2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1832 2.6951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4265 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7115 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7115 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0035 -2.0625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8958 -2.6951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4265 -2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9559 -2.6951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9828 -1.5400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7185 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4335 -2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7185 -0.8250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1471 -1.6514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8607 -2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5744 -1.6514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2880 -2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0016 -1.6514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7153 -2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4289 -1.6514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1427 -2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 3 11 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 6 12 1 0 0 0 0 6 16 1 0 0 0 0 8 9 1 0 0 0 0 10 11 1 0 0 0 0 10 23 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 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 32 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 19 30 1 0 0 0 0 20 21 1 0 0 0 0 20 25 1 0 0 0 0 22 23 1 0 0 0 0 23 24 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 27 30 1 0 0 0 0 28 33 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 33 34 1 0 0 0 0 33 35 2 0 0 0 0 34 36 1 0 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 42 43 1 0 0 0 0 M END > NP0329742 > NP-MRD > CCCCCCCCCC(=O)OC1CCC2(C)C(CCC3(C)C2CC=C2C4CC(C)(C)CCC4(CO)CCC32C)C1(C)C > InChI=1S/C40H68O3/c1-9-10-11-12-13-14-15-16-34(42)43-33-20-21-37(6)31(36(33,4)5)19-22-39(8)32(37)18-17-29-30-27-35(2,3)23-25-40(30,28-41)26-24-38(29,39)7/h17,30-33,41H,9-16,18-28H2,1-8H3 > GFJZQJRUULUPGX-UHFFFAOYSA-N > C40H68O3 > 596.9661 > 596.516846042 > 2 > 76.00924081834057 > 0 > 1 > 0 > 0 > 8a-(hydroxymethyl)-4,4,6a,6b,11,11,14b-heptamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-icosahydropicen-3-yl decanoate > 9.73 > 10.376011590000001 > -7.45 > 1 > 5 > 0 > 18.92077743176088 > -1.083851473894557 > 46.53 > 179.66740000000004 > 11 > 0 > 2.10e-05 g/l > 8a-(hydroxymethyl)-4,4,6a,6b,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl decanoate > 0 > NP0329742 > 8a-(hydroxymethyl)-4,4,6a,6b,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl decanoate $$$$