Mol:FL5FFCGL0010

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Copyright: ARM project http://www.metabolome.jp/
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M  STY  1   3 SUP
M  SLB  1   3   3
M  SAL   3  2  31  32
M  SBL   3  1  34
M  SMT   3  CH2OH
M  SVB   3 34     2.914   -1.9612
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  35  36
M  SBL   2  1  38
M  SMT   2  OCH3
M  SVB   2 38   -1.8849    0.9762
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  33  34
M  SBL   1  1  36
M  SMT   1  OCH3
M  SVB   1 36    0.9124    1.9612
S  SKP  8
ID	FL5FFCGL0010
KNApSAcK_ID	C00005715
NAME	Limocitrin 3-glucoside
CAS_RN	38836-51-0
FORMULA	C23H24O13
EXACTMASS	508.121690854
AVERAGEMASS	508.42886
SMILES	O(c(c(O)4)cc(cc4)C(=C(O[C@H](O3)C(O)C([C@H]([C@@H](CO)3)O)O)2)Oc(c1C2=O)c(OC)c(cc(O)1)O)C
M  END

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