Mol:FL3FRNND0001
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 32 37 0 0 0 0 0 0 0 0999 V2000 -1.0984 -0.7017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0984 0.1233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8129 0.5358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8129 -1.1142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3840 -1.1141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3305 -0.7016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3305 0.1234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3840 0.5358 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3840 -1.9391 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5274 -0.7017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5274 0.1233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8129 -1.9392 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0450 -1.1141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7595 -0.7016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7595 0.1234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0450 0.5359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4739 0.5359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4739 1.3609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7595 1.7734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0450 1.3609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0440 0.2067 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0465 -0.7016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0465 -1.5266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8712 -0.7016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3305 1.7734 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0653 1.7023 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8129 1.3608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5274 1.7733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2419 1.3608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2419 0.5358 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5757 1.9392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8712 1.1922 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 3 11 2 0 0 0 0 10 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 5 9 2 0 0 0 0 11 10 1 0 0 0 0 4 12 1 0 0 0 0 6 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 7 1 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 20 16 1 0 0 0 0 20 25 1 0 0 0 0 17 21 1 0 0 0 0 14 22 1 0 0 0 0 22 21 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 18 26 1 0 0 0 0 3 27 1 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 11 1 0 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 S SKP 8 ID FL3FRNND0001 KNApSAcK_ID C00013485 NAME Cycloartobiloxanthone;5a,6-Dihydro-1,3,8-trihydroxy-5,5,11,11-tetramethyl-5H,7H,11H-benzofuro[3,4-bc]pyrano[3,2-h]xanthen-7-one CAS_RN 121748-26-3 FORMULA C25H22O7 EXACTMASS 434.136553058 AVERAGEMASS 434.43798000000004 SMILES O(c45)C(c32)=C(C(=O)c(c(cc(O6)c(C=CC6(C)C)5)O)4)CC(c13)C(Oc(c(O)cc2O)1)(C)C M END