Mrv1533004241503382D 24 27 0 0 0 0 999 V2000 5.9734 -1.1065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2411 -1.4865 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2041 -2.3107 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5459 -1.0424 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8136 -1.4224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1184 -0.9782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8017 -1.7400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6765 -0.3707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4294 0.4164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6242 0.5960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0661 -0.0115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8257 0.7777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3132 -0.7987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7596 -1.4229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9506 -1.2543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6469 -0.4671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1726 0.0666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4028 0.5335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0916 0.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1586 1.1914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0038 1.0309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2474 0.1857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7854 -0.2403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1637 -0.8483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 2 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 6 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 11 13 1 0 0 0 0 6 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 18 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 11 22 1 0 0 0 0 16 22 1 0 0 0 0 18 23 1 0 0 0 0 23 24 2 0 0 0 0 16 24 1 0 0 0 0 M END > NP0284019 > NP-MRD > CC(=O)OCC1(C)CCCC2(C)C3CCC4(C)CC3(CCC12)C=C4 > InChI=1S/C22H34O2/c1-16(23)24-15-20(3)8-5-9-21(4)17(20)7-11-22-13-12-19(2,14-22)10-6-18(21)22/h12-13,17-18H,5-11,14-15H2,1-4H3 > GFQMRZFTUAYSTG-UHFFFAOYSA-N > C22H34O2 > 330.512 > 330.255880335 > 1 > 58 > 39.626242152094704 > 1 > 0 > 0 > 1 > {5,9,13-trimethyltetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadec-14-en-5-yl}methyl acetate > 4.70 > 4.7752445969999995 > -6.86 > 0 > 4 > 0 > -6.9950299512994585 > 26.3 > 97.8382 > 3 > 1 > 4.53e-05 g/l > {5,9,13-trimethyltetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadec-14-en-5-yl}methyl acetate > 1 > NP0284019 > {5,9,13-trimethyltetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadec-14-en-5-yl}methyl acetate $$$$