Mol:FL5FADGL0010

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Copyright: ARM project http://www.metabolome.jp/
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M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  41  42
M  SBL   2  1  45
M  SMT   2  CH2OH
M  SVB   2 45     0.886   -2.5753
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  43  44
M  SBL   1  1  47
M  SMT   1  OCH3
M  SVB   1 47    1.3071    3.1586
S  SKP  8
ID	FL5FADGL0010
KNApSAcK_ID	C00005547
NAME	Isorhamnetin 3-neohesperidoside
CAS_RN	55033-90-4
FORMULA	C28H32O16
EXACTMASS	624.1690349759999
AVERAGEMASS	624.54408
SMILES	[C@@H]([C@H](O)1)([C@@H](C(C)O[C@@H]1OC(C(O)2)[C@H](OC(=C4c(c5)cc(OC)c(O)c5)C(=O)c(c3O4)c(cc(c3)O)O)O[C@H](CO)[C@H](O)2)O)O
M  END

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