Mol:FL7AAAGL0064
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
77 84 0 0 0 0 0 0 0 0999 V2000
-1.3659 3.3430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
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S SKP 8
ID FL7AAAGL0064
KNApSAcK_ID C00014840
NAME Pelargonidin 3-O-[2-O-(6-(E)-feruloyl-beta-D-glucopyranosyl)-6-O-(E)-p-coumaroyl-beta-D-glucopyranoside]-5-O-(beta-D-glucopyranoside);Pelargonidin 3-(2-(6-ferulylglucosyl)-6-p-coumarylglucoside)-5-glucoside
CAS_RN 448963-08-4
FORMULA C52H55O25
EXACTMASS 1079.3032423099999
AVERAGEMASS 1079.9780999999998
SMILES C(C(C4O)OC(Oc(c8)c([o+1]c(c86)cc(cc6OC(C(O)7)OC(C(C7O)O)CO)O)c(c5)ccc(c5)O)C(C4O)OC(C(O)3)OC(C(O)C3O)COC(C=Cc(c2)ccc(O)c2OC)=O)OC(C=Cc(c1)ccc(O)c1)=O
M END
