Mol:FL3F19NF0007
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 28 32 0 0 0 0 0 0 0 0999 V2000 -0.5851 -1.3479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5851 -0.5229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2995 -0.1104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2995 -1.7604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1294 -1.7604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8439 -1.3479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8439 -0.5229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1294 -0.1104 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5584 -0.1104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2728 -0.5229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9873 -0.1104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9873 0.7146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2728 1.1271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5583 0.7146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1294 -2.4279 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0140 -1.3479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0140 -0.5229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4711 0.6965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2915 0.7828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6271 0.0291 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1355 1.4502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7486 2.0022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4631 1.5897 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1117 2.3653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3230 2.4279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4457 1.4502 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9873 0.7828 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7559 0.6965 0.0000 H 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 3 17 2 0 0 0 0 16 4 2 0 0 0 0 4 1 1 0 0 0 0 1 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 2 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 9 1 0 0 0 0 5 15 2 0 0 0 0 17 16 1 0 0 0 0 3 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 17 1 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 19 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 21 26 1 1 0 0 0 19 27 1 6 0 0 0 18 28 1 6 0 0 0 S SKP 8 ID FL3F19NF0007 KNApSAcK_ID C00013467 NAME (-)-Pseudosemiglabrinol;Pseudosemiglabrinol;(7aS,10S,10aR)-7a,9,10,10a-Tetrahydro-10-hydroxy-9,9-dimethyl-2-phenyl-4H-furo[3',2':4,5]furo[2,3-h]-1-benzopyran-4-one CAS_RN 102916-89-2 FORMULA C21H18O5 EXACTMASS 350.115423686 AVERAGEMASS 350.36462 SMILES OC(C5(C)C)C(c14)([H])C([H])(O5)Oc1ccc(c34)C(=O)C=C(O3)c(c2)cccc2 M END