Marvin 03191310322D 35 38 0 0 0 0 999 V2000 9.6062 -15.4188 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.6074 -14.4394 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.8199 -13.6394 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1247 -13.1901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4825 -13.7124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7809 -14.4845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3532 -14.0959 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4159 -15.2464 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.9248 -15.8975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7507 -15.9034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0932 -14.4606 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.2730 -15.2662 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.4853 -14.1500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6967 -13.9008 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6650 -14.9556 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.0573 -15.5131 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.3997 -16.2635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2192 -16.1697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3831 -15.3614 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.0798 -12.3663 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8728 -13.6605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8291 -14.7236 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6103 -16.1153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2478 -14.3646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1336 -15.0189 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 15.8055 -15.4976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1358 -14.1976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7269 -16.3188 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.5560 -15.1550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9645 -15.9438 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3515 -16.2035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5446 -16.3753 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8062 -15.2021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1895 -14.7021 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1978 -16.0396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2 3 1 6 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 2 6 1 0 0 0 0 2 7 1 0 0 0 0 7 11 1 0 0 0 0 2 8 1 0 0 0 0 8 9 1 0 0 0 0 12 10 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 16 1 0 0 0 0 15 13 1 0 0 0 0 13 14 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 19 15 1 0 0 0 0 4 20 2 0 0 0 0 8 1 1 0 0 0 0 11 21 1 6 0 0 0 12 22 1 6 0 0 0 16 23 1 6 0 0 0 15 24 1 1 0 0 0 19 25 1 0 0 0 0 25 26 1 6 0 0 0 25 27 1 0 0 0 0 26 28 2 0 0 0 0 26 29 1 0 0 0 0 19 30 1 6 0 0 0 1 31 1 0 0 0 0 31 32 1 0 0 0 0 1 33 1 6 0 0 0 1 34 1 0 0 0 0 8 35 1 6 0 0 0 M END > CHEBI:66542 > lancifodilactone F > A tetracyclic triterpenoid that is a rearranged pentanortriterpenoid derived from cycloartane. Isolated from the leaves and stem of Schisandra lancifolia, it exhibits anti-HIV activity. > 3 > (2S)-2-{(3R,3aR,5aR,7R,8S,10aS,10bS)-8-[(2S)-1,2-dihydroxypropan-2-yl]-3a,10b-dimethyl-5'-oxotetradecahydro-1H,3'H-spiro[cyclohepta[e]indene-7,2'-furan]-3-yl}propanoic acid > C25H40O6 > 436.58150 > 436.28249 > 0 > [H][C@]12CC[C@]3(C)[C@]([H])(CC[C@@]3(C)[C@@]1([H])CC[C@@]([H])([C@](C)(O)CO)[C@@]1(CCC(=O)O1)C2)[C@H](C)C(O)=O > InChI=1S/C25H40O6/c1-15(21(28)29)17-8-11-23(3)18-5-6-19(24(4,30)14-26)25(12-9-20(27)31-25)13-16(18)7-10-22(17,23)2/h15-19,26,30H,5-14H2,1-4H3,(H,28,29)/t15-,16+,17+,18-,19-,22+,23-,24+,25+/m0/s1 > GFRDTMTUJTYIJJ-IUSUREMMSA-N > 10049664 > 15787482; 18303901; 22133065 $$$$