Mol:FL3FCACS0033
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
56 61 0 0 0 0 0 0 0 0999 V2000
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S SKP 8
ID FL3FCACS0033
KNApSAcK_ID C00014096
NAME Isoswertisin 6'''-O-feruloyl 2''-O-glucoside
CAS_RN 319480-85-8
FORMULA C38H40O18
EXACTMASS 784.2214644759999
AVERAGEMASS 784.7134
SMILES c(c1)(ccc(C(=C3)Oc(c(C(O4)C(OC(C(O)5)OC(COC(C=Cc(c6)ccc(c(OC)6)O)=O)C(O)C5O)C(O)C(O)C(CO)4)2)c(C3=O)c(O)cc2OC)c1)O
M END
