Mrv1652309072214112D 35 38 0 0 1 0 999 V2000 7.8761 -2.1525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0784 -1.3527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4869 -0.7776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6931 -1.0023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1016 -0.4271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3078 -0.6518 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.1055 -1.4516 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7163 -0.0767 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.8339 0.7399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0936 1.1040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5185 0.5125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6941 0.5441 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2545 -0.1540 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.6394 -0.8837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4638 -0.9154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9033 -0.2172 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.3623 -0.9027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4547 0.0483 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5952 -0.7646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7692 -0.4107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0289 -0.0465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0258 0.7767 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7661 1.1409 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8208 1.9640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5611 2.3282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1353 2.4230 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6597 1.2357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4000 0.8715 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4316 1.6959 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1660 1.1779 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3683 1.9777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1621 2.2024 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6892 0.0222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0977 0.5974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4830 0.2469 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 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 1 0 0 0 8 6 1 6 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 11 10 1 6 0 0 0 12 11 1 1 0 0 0 12 13 1 0 0 0 0 13 14 1 6 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 11 16 1 0 0 0 0 8 16 1 0 0 0 0 16 17 1 6 0 0 0 13 18 1 0 0 0 0 18 19 1 6 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 6 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 2 0 0 0 0 22 27 1 0 0 0 0 27 28 1 0 0 0 0 18 28 1 0 0 0 0 28 29 1 6 0 0 0 28 30 1 0 0 0 0 12 30 1 0 0 0 0 30 31 1 6 0 0 0 31 32 2 0 0 0 0 3 33 1 0 0 0 0 33 34 1 0 0 0 0 33 35 1 0 0 0 0 M END > NP0249596 > NP-MRD > C\C=C(/CC[C@@H](C)[C@H]1CC[C@H]2[C@H]3[C@H](CC[C@]12C)[C@@]1(C)CC[C@@H](C[C@@]1(O)[C@@H]3C=O)OC(C)=O)C(C)C > InChI=1S/C31H50O4/c1-8-22(19(2)3)10-9-20(4)24-11-12-25-28-26(14-15-29(24,25)6)30(7)16-13-23(35-21(5)33)17-31(30,34)27(28)18-32/h8,18-20,23-28,34H,9-17H2,1-7H3/b22-8+/t20-,23+,24-,25+,26+,27-,28+,29-,30-,31-/m1/s1 > JRDSIXZVXZHOAZ-HSABDOIUSA-N > C31H50O4 > 486.737 > 486.37091009 > 3 > 85 > 58.866179097445446 > 1 > 1 > 0 > 0 > (3R,3aR,5aS,5bR,8S,9aR,10R,10aS,10bS)-10-formyl-9a-hydroxy-3a,5b-dimethyl-3-[(2R,5E)-5-(propan-2-yl)hept-5-en-2-yl]-hexadecahydrocyclopenta[a]fluoren-8-yl acetate > 5.828975487333336 > 1 > 4 > 0 > 17.316077425033807 > 13.908160380914232 > -3.2745287354852604 > 63.6 > 140.9616 > 8 > 0 > (3R,3aR,5aS,5bR,8S,9aR,10R,10aS,10bS)-10-formyl-9a-hydroxy-3-[(2R,5E)-5-isopropylhept-5-en-2-yl]-3a,5b-dimethyl-dodecahydro-1H-cyclopenta[a]fluoren-8-yl acetate > 0 > NP0249596 > (3r,3ar,5as,5br,8s,9ar,10r,10as,10bs)-10-formyl-9a-hydroxy-3-[(2r,5e)-5-isopropylhept-5-en-2-yl]-3a,5b-dimethyl-dodecahydro-1h-cyclopenta[a]fluoren-8-yl acetate $$$$