Marvin 04241315172D 21 22 0 0 0 0 999 V2000 -1.6045 -20.9500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.6045 -21.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8919 -22.1854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8919 -20.5354 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.1792 -20.9500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.1827 -21.7750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.5225 -22.1903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2399 -21.7811 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2434 -20.9560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5295 -20.5402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8919 -19.7103 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3208 -20.5416 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8910 -23.0105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1908 -22.5959 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1866 -20.1249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9527 -22.1997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6701 -21.7890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9481 -23.0247 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6618 -22.6083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6747 -20.9640 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2356 -22.6043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9 10 1 0 0 0 0 5 6 1 0 0 0 0 4 11 1 6 0 0 0 1 12 1 1 0 0 0 1 2 1 0 0 0 0 3 13 2 0 0 0 0 1 4 1 0 0 0 0 6 14 1 1 0 0 0 2 3 1 0 0 0 0 5 15 1 6 0 0 0 3 6 1 0 0 0 0 8 16 1 0 0 0 0 5 4 1 0 0 0 0 16 17 1 0 0 0 0 5 10 1 0 0 0 0 16 18 1 0 0 0 0 6 7 1 0 0 0 0 16 19 1 0 0 0 0 7 8 1 0 0 0 0 17 20 1 0 0 0 0 8 9 1 0 0 0 0 8 21 1 1 0 0 0 M END > CHEBI:66607 > lyratol C > An sesquiterpenoid that is decahydronaphthalene substituted by hydroxy groups at positions 1 and 2, a methyl group at position 8a, a methylidene group at position 4 and a 1,2-dihydroxypropan-2-yl at position 6 (the 1R,2R,4aR,6S,8aS stereoisomer) . Isolated from Solanum lyratum, it exhibits cytotoxicity against human cancer cell lines. > 3 > (1R,2R,4aR,6S,8aS)-6-[(2S)-1,2-dihydroxypropan-2-yl]-8a-methyl-4-methylidenedecahydronaphthalene-1,2-diol > C15H26O4 > 270.36450 > 270.18311 > 0 > [H][C@@]1(CC[C@]2(C)[C@@H](O)[C@H](O)CC(=C)[C@@]2([H])C1)C(C)(O)CO > InChI=1S/C15H26O4/c1-9-6-12(17)13(18)14(2)5-4-10(7-11(9)14)15(3,19)8-16/h10-13,16-19H,1,4-8H2,2-3H3/t10-,11+,12+,13-,14-,15?/m0/s1 > QLYUSONKBWKHRY-MKGDQNAVSA-N > 19683900 > 19336938 $$$$