Mrv1652309092221432D 36 40 0 0 1 0 999 V2000 3.4412 5.3736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7521 4.6094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2457 3.9581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5693 4.4966 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.8802 3.7324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6974 3.6196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0083 2.8554 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.8256 2.7425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5020 2.2041 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.7313 1.4116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0484 0.9486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3971 1.4549 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.1995 0.6540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5850 1.3097 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.3047 0.5338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4926 0.3886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9608 1.0193 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1486 0.8741 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8683 0.0982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6168 1.5048 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.1953 1.3596 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7271 1.9903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5392 1.8451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4468 2.7662 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8971 2.2807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7092 2.4259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2411 1.7952 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.5214 2.5711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0532 1.9404 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.3335 2.7164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1456 2.8616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6774 2.2309 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.0373 2.9732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0757 5.1479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7648 5.9121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8929 5.0351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 4 2 1 1 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 1 0 0 0 9 7 1 1 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 6 0 0 0 12 14 1 0 0 0 0 14 15 1 1 0 0 0 15 16 1 0 0 0 0 17 16 1 6 0 0 0 17 18 1 0 0 0 0 18 19 1 6 0 0 0 18 20 1 0 0 0 0 20 21 1 1 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 24 2 0 0 0 0 20 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 17 27 1 0 0 0 0 27 28 1 1 0 0 0 29 28 1 6 0 0 0 14 29 1 0 0 0 0 27 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 9 32 1 0 0 0 0 12 32 1 0 0 0 0 32 33 1 1 0 0 0 4 34 1 0 0 0 0 34 35 1 0 0 0 0 34 36 1 0 0 0 0 M END > NP0289507 > NP-MRD > CC(C)[C@@H](CC[C@@H](C)[C@H]1CC[C@@]2(C)[C@H]3CC[C@@H]4[C@H](C)[C@H](CC[C@@]44C[C@]34CC[C@]12C)OC(C)=O)C(C)=C > InChI=1S/C34H56O2/c1-21(2)26(22(3)4)11-10-23(5)27-14-16-32(9)30-13-12-28-24(6)29(36-25(7)35)15-17-33(28)20-34(30,33)19-18-31(27,32)8/h22-24,26-30H,1,10-20H2,2-9H3/t23-,24+,26+,27-,28-,29+,30-,31-,32+,33-,34-/m1/s1 > CFCDWJUKFDUOGZ-IAUHBXLLSA-N > C34H56O2 > 496.82 > 496.428031043 > 1 > 92 > 62.75367247851512 > 1 > 0 > 0 > 0 > (1R,3R,6S,7S,8R,11R,12S,15R,16R)-7,12,16-trimethyl-15-[(2R,5R)-6-methyl-5-(propan-2-yl)hept-6-en-2-yl]pentacyclo[9.7.0.0^{1,3}.0^{3,8}.0^{12,16}]octadecan-6-yl acetate > 8.687327467666668 > 1 > 5 > 0 > -7.003184723833185 > 26.3 > 149.41230000000002 > 8 > 0 > (1R,3R,6S,7S,8R,11R,12S,15R,16R)-15-[(2R,5R)-5-isopropyl-6-methylhept-6-en-2-yl]-7,12,16-trimethylpentacyclo[9.7.0.0^{1,3}.0^{3,8}.0^{12,16}]octadecan-6-yl acetate > 1 > NP0289507 > (1r,3r,6s,7s,8r,11r,12s,15r,16r)-15-[(2r,5r)-5-isopropyl-6-methylhept-6-en-2-yl]-7,12,16-trimethylpentacyclo[9.7.0.0¹,³.0³,⁸.0¹²,¹⁶]octadecan-6-yl acetate $$$$