CDK 1029232202 18 20 0 0 0 0 0 0 0 0999 V2000 -3.0089 -1.6734 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1839 -1.6734 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.2455 -0.8507 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.5023 -2.1381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5964 -2.3878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6408 -0.2895 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.9661 -0.4489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7139 -1.8950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9876 0.4590 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.8250 -0.4125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.8067 0.3605 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.4125 -1.1270 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.5858 1.1796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.4125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.3678 0.9653 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5834 -0.9959 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4290 -0.4125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 1 0 0 0 3 2 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 6 3 1 1 0 0 0 3 7 1 1 0 0 0 4 8 1 0 0 0 0 9 6 1 0 0 0 0 10 6 1 6 0 0 0 11 7 1 0 0 0 0 12 8 1 6 0 0 0 9 13 1 1 0 0 0 14 10 1 0 0 0 0 11 15 1 6 0 0 0 14 16 1 0 0 0 0 14 17 1 6 0 0 0 16 18 1 0 0 0 0 9 11 1 0 0 0 0 10 12 1 0 0 0 0 12 14 1 0 0 0 0 M END > CHEBI:203997 > 3beta,13-dihydroxyledol > 2 > (1S,1aR,4R,4aS,6S,7S,7aR,7bS)-1-(hydroxymethyl)-1,4,7-trimethyl-2,3,4a,5,6,7,7a,7b-octahydro-1aH-cyclopropa[e]azulene-4,6-diol > C15H26O3 > 254.370 > 254.18819 > 0 > O[C@]1([C@@H]2[C@@H]([C@H](C)[C@H](C2)O)[C@@H]3[C@](CO)(C)[C@@H]3CC1)C > InChI=1S/C15H26O3/c1-8-11(17)6-10-12(8)13-9(14(13,2)7-16)4-5-15(10,3)18/h8-13,16-18H,4-7H2,1-3H3/t8-,9-,10+,11+,12-,13-,14+,15-/m1/s1 > DPIHDXXCXGFSJX-RZULFSQCSA-N $$$$