Mol:FL3FQUNP0003
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 33 38 0 0 0 0 0 0 0 0999 V2000 -0.7163 -0.8062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7116 0.0188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0041 -1.2227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7127 -0.8143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7174 0.0107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0052 0.4272 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4248 -1.2309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1416 -0.8224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1463 0.0026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4342 0.4191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4237 0.4353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1405 0.0269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1452 -0.7981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4331 -1.2146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8554 0.4240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8523 1.2620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1402 1.6786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4311 1.2571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4331 -1.8453 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0041 -1.8307 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8440 1.5961 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5264 0.0366 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4444 1.6039 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4342 -0.4059 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8609 -1.2377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8609 -1.8448 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5160 -0.8595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4237 1.2603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1405 1.6769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8573 1.2603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8573 0.4353 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1950 1.8453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5264 1.0810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 6 2 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 2 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 1 2 0 0 0 0 9 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 18 10 1 0 0 0 0 14 19 1 0 0 0 0 3 20 2 0 0 0 0 18 21 2 0 0 0 0 15 22 2 0 0 0 0 16 23 1 0 0 0 0 10 24 1 0 0 0 0 24 9 1 0 0 0 0 8 25 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 11 28 1 0 0 0 0 28 29 2 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 12 1 0 0 0 0 30 32 1 0 0 0 0 30 33 1 0 0 0 0 S SKP 8 ID FL3FQUNP0003 KNApSAcK_ID C00013495 NAME Artonin P;8,9-Dihydro-6,11-dihydroxy-3,3-dimethyl-9-(1-methylethenyl)-9a,13a-epoxy-3H,7H-benzo[c]pyrano[3,2-h]xanthene-7,10,13-trione CAS_RN 151606-37-0 FORMULA C25H20O8 EXACTMASS 448.11581761599996 AVERAGEMASS 448.4215 SMILES Oc(c2)c(C(=O)3)c(OC(C456)=C3CC(C4(C(C(=CC6=O)O)=O)O5)C(C)=C)c(c21)C=CC(C)(C)O1 M END