Mol:066b FLIC
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 28 31 0 0 0 0 0 0 0 0999 V2000 -2.1557 -0.0854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1557 -0.9102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4413 -1.3228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7268 -0.9102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7268 -0.0854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4413 0.3272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0123 -1.3228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7021 -0.9102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7021 -0.0854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0123 0.3272 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4163 -1.3227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4163 -2.2047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1802 -2.6459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9441 -2.2047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9441 -1.3227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1802 -0.8815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8701 -1.3227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4413 -2.1478 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6586 -2.6172 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1802 -0.0565 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8947 0.3560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1557 -2.5603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4211 1.2169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7567 0.4633 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6006 1.1307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8336 1.9314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4211 2.6459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6586 1.9314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 1 1 0 4 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 5 1 0 8 11 1 0 11 12 1 0 12 13 2 0 14 15 2 0 15 16 1 0 16 11 2 0 1 2 2 0 13 14 1 0 2 17 1 0 3 18 1 0 14 19 1 0 16 20 1 0 20 21 1 0 18 22 1 0 23 24 1 0 25 23 1 0 6 25 1 0 1 24 1 0 23 26 1 0 26 27 1 0 26 28 2 0 S SKP 5 ID 066b FLIC FORMULA C23H26O5 EXACTMASS 382.178023942 AVERAGEMASS 382.44954 SMILES COc(c4)c(ccc(O)4)C(C3)Cc(c(OC)1)c(O3)c(C2)c(OC(C(C)=C)2)c(C)1 M END