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Mol:FL7AAGGL0024 - Revision history
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Copyright: ARM project http://www.metabolome.jp/<br />
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M STY 1 1 SUP<br />
M SLB 1 1 1<br />
M SAL 1 3 57 58 60<br />
M SBL 1 1 62<br />
M SMT 1 COOH<br />
M SVB 1 62 -4.0635 0.6104<br />
S SKP 8<br />
ID FL7AAGGL0024<br />
KNApSAcK_ID C00006887<br />
NAME Monodemalonylsalviadelphin;Delphinidin 3-[6-(caffeoylglucoside)]-5-[6-(malonylglucoside)]<br />
CAS_RN 128508-46-3,144607-77-2<br />
FORMULA C39H39O23<br />
EXACTMASS 875.1882125540001<br />
AVERAGEMASS 875.71316<br />
SMILES [C@H](O)([C@@H]1Oc(c6)c(c3cc6O)cc(O[C@@H](C5O)O[C@@H]([C@@H](C(O)5)O)COC(=O)C=Cc(c4)ccc(O)c4O)c([o+1]3)c(c2)cc(O)c(O)c2O)[C@@H](O)[C@@H](O)C(COC(CC(O)=O)=O)O1<br />
M END<br />
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