Mol:FL1DACCS0001

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Copyright: ARM project http://www.metabolome.jp/
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M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  31  32
M  SBL   1  1  33
M  SMT   1 ^CH2OH
M  SBV   1 33   -6.6797    8.0128
S  SKP  8
ID	FL1DACCS0001
KNApSAcK_ID	C00006096
NAME	Aspalathin;3-(3,4-Dihydroxyphenyl)-1-(3-beta-D-glucopyranosyl-2,4,6-trihydroxyphenyl)-1-propanone
CAS_RN	6027-43-6
FORMULA	C21H24O11
EXACTMASS	452.13186161
AVERAGEMASS	452.40866
SMILES	c(c(O)1)(O)ccc(CCC(=O)c(c2O)c(O)cc(c2C(C(O)3)OC(CO)C(O)C3O)O)c1
M  END

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