Mol:FL2FAANF0011
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 28 32 0 0 0 0 0 0 0 0999 V2000 0.3517 -0.6623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3659 0.1626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1066 -1.0878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7804 -0.6869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7712 0.1795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0874 0.5627 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4857 0.5920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1066 -1.8295 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2002 0.1795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9146 0.5920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9146 1.4170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2002 1.8295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4857 1.4170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3414 0.5873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3414 -1.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3414 -1.7651 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5352 1.7753 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0628 -0.6377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0628 0.1871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7770 0.6010 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4925 0.1871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4925 -0.6377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2069 0.5996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9213 0.1871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9213 -0.6377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2069 -1.0502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4918 0.5165 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5352 -0.9922 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 2 1 0 0 0 0 5 7 1 6 0 0 0 3 8 2 0 0 0 0 7 9 2 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 7 1 0 0 0 0 2 14 1 0 0 0 0 14 19 2 0 0 0 0 18 15 2 0 0 0 0 15 1 1 0 0 0 0 15 16 1 0 0 0 0 11 17 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 18 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 26 22 1 0 0 0 0 24 27 1 0 0 0 0 25 28 1 0 0 0 0 S SKP 8 ID FL2FAANF0011 KNApSAcK_ID C00014272 NAME Anastatin A;(2S)-2,3-Dihydro-5,7,8-trihydroxy-2-(4-hydroxyphenyl)-4H-Benzofuro[3,2-g]-1-benzopyran-4-one CAS_RN 571186-32-8 FORMULA C21H14O7 EXACTMASS 378.073952802 AVERAGEMASS 378.33165999999994 SMILES o(c45)c(c1)c(c4cc(O)c(O)c5)c(c(C(=O)3)c1OC(C3)c(c2)ccc(O)c2)O M END