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Mol:FL7AAIGL0020 - Revision history
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Copyright: ARM project http://www.metabolome.jp/<br />
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M STY 1 3 SUP<br />
M SLB 1 3 3<br />
M SAL 3 2 62 63<br />
M SBL 3 1 67<br />
M SMT 3 OCH3<br />
M SVB 3 67 0.8277 1.2645<br />
M STY 1 2 SUP<br />
M SLB 1 2 2<br />
M SAL 2 2 60 61<br />
M SBL 2 1 65<br />
M SMT 2 OCH3<br />
M SVB 2 65 0.3346 3.0289<br />
M STY 1 1 SUP<br />
M SLB 1 1 1<br />
M SAL 1 3 56 57 58<br />
M SBL 1 1 61<br />
M SMT 1 COOH<br />
M SVB 1 61 -5.7809 0.5932<br />
S SKP 8<br />
ID FL7AAIGL0020<br />
KNApSAcK_ID C00006911<br />
NAME Salviamalvin<br />
CAS_RN 128508-48-5<br />
FORMULA C41H43O22<br />
EXACTMASS 887.22459806<br />
AVERAGEMASS 887.76692<br />
SMILES [C@@H]([C@@H](O)6)([C@H](O)[C@@H](OC6COC(=O)CC(O)=O)Oc(c21)cc(cc1[o+1]c(c(c5)cc(c(c5OC)O)OC)c(O[C@H](O3)C(C([C@@H](O)[C@@H](COC(C=Cc(c4)ccc(O)c4)=O)3)O)O)c2)O)O<br />
M END<br />
</pre></div>
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