Mol:FL2FA9NM0017
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 23 25 0 0 0 0 0 0 0 0999 V2000 -2.1450 0.3961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1438 -0.4271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4271 -0.8395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7148 -0.4268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7150 0.3982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4295 0.8105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0019 -0.8392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7141 -0.4266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7129 0.4002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0005 0.8108 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4295 0.8091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1429 0.3986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8573 0.8112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8572 1.6362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1427 2.0486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4283 1.6360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0024 -1.6642 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4313 -1.6644 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8573 0.8122 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4295 1.5637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8052 -0.8089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1176 -2.0607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9325 2.0607 0.0000 O 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 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 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 9 11 1 6 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 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 7 17 2 0 0 0 0 3 18 1 0 0 0 0 1 19 1 0 0 0 0 6 20 1 0 0 0 0 2 21 1 0 0 0 0 18 22 1 0 0 0 0 20 23 2 0 0 0 0 S SKP 8 ID FL2FA9NM0017 KNApSAcK_ID C00014153 NAME Desmosflavanone II;7-Hydroxy-5-methoxy-6-methyl-8-formylflavanone CAS_RN 219917-96-1 FORMULA C18H16O5 EXACTMASS 312.099773622 AVERAGEMASS 312.31664 SMILES O(C2c(c3)cccc3)c(c1C=O)c(C(=O)C2)c(c(c1O)C)OC M END