CDK 1029232202 25 28 0 0 0 0 0 0 0 0999 V2000 3.6946 -2.4995 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6825 -1.6700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8546 -1.3579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2866 -1.2374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1448 -1.7618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8833 -0.5088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0010 -0.8249 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2866 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4347 -1.7186 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1433 -2.4748 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 -1.2374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4621 -0.0138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1433 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6974 0.0653 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.3876 -2.5671 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7890 -1.0999 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4289 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3687 0.8589 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6803 0.8506 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8422 -0.2735 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1408 -1.4614 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7144 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4452 0.3019 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0466 -0.4364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.4125 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 2 4 1 0 0 0 0 3 5 2 0 0 0 0 3 6 1 0 0 0 0 4 7 1 0 0 0 0 4 8 1 0 0 0 0 9 4 1 0 0 0 0 5 10 1 0 0 0 0 5 11 1 0 0 0 0 6 12 1 0 0 0 0 6 13 2 0 0 0 0 14 8 1 0 0 0 0 9 15 1 1 0 0 0 16 9 1 0 0 0 0 11 17 2 0 0 0 0 12 18 2 0 0 0 0 14 19 1 1 0 0 0 20 14 1 0 0 0 0 16 21 1 6 0 0 0 17 22 1 0 0 0 0 20 23 1 6 0 0 0 20 24 1 0 0 0 0 22 25 1 0 0 0 0 7 8 1 0 0 0 0 8 12 1 0 0 0 0 13 17 1 0 0 0 0 16 20 1 0 0 0 0 M END > CHEBI:204267 > Altersolanol O > 2 > (11R,12S,13S,14S)-4,11,12,13,14-pentahydroxy-6-methoxy-12-methyl-15-oxatetracyclo[8.4.1.01,10.03,8]pentadeca-3(8),4,6-triene-2,9-dione > C16H16O9 > 352.295 > 352.07943 > 0 > O=C1C2=C(O)C=C(OC)C=C2C(=O)C34C1(O3)[C@@H](O)[C@H](O)[C@@]([C@H]4O)(O)C > InChI=1S/C16H16O9/c1-14(23)11(20)12(21)15-10(19)8-6(3-5(24-2)4-7(8)17)9(18)16(15,25-15)13(14)22/h3-4,11-13,17,20-23H,1-2H3/t11-,12-,13+,14-,15?,16?/m0/s1 > IGQRNPSFVHAGKN-CROFZZMPSA-N $$$$