Mol:FL7AAIGL0010

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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  37  38
M  SBL   2  1  40
M  SMT   2  OCH3
M  SVB   2 40    0.8158    0.9079
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  35  36
M  SBL   1  1  38
M  SMT   1  OCH3
M  SVB   1 38    0.3226    2.6723
S  SKP  8
ID	FL7AAIGL0010
KNApSAcK_ID	C00006901
NAME	Malvidin 3-(6''-acetylglucoside)
CAS_RN	101072-66-6,114051-26-2,122798-00-9
FORMULA	C25H27O13
EXACTMASS	535.14516595
AVERAGEMASS	535.47408
SMILES	c(c1)(c(c(cc1c([o+1]2)c(O[C@@H](C4O)O[C@H](COC(C)=O)[C@@H](C(O)4)O)cc(c3O)c2cc(c3)O)OC)O)OC
M  END

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