Mol:FLIF1LGF0004

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Copyright: ARM project http://www.metabolome.jp/
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M  STY  1   4 SUP
M  SLB  1   4   4
M  SAL   4  2  39  40
M  SBL   4  1  44
M  SMT   4  CH2OH
M  SVB   4 44   -3.3227    2.4649
M  STY  1   3 SUP
M  SLB  1   3   3
M  SAL   3  2  37  38
M  SBL   3  1  42
M  SMT   3  CH2OH
M  SVB   3 42   -0.1395    2.1162
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  41  42
M  SBL   2  1  46
M  SMT   2  OCH3
M  SVB   2 46    2.5258   -2.0962
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  35  36
M  SBL   1  1  40
M  SMT   1  OCH3
M  SVB   1 40    3.7101    -1.825
S  SKP  8
ID	FLIF1LGF0004
KNApSAcK_ID	C00010179
NAME	Amorphigenol O-glucoside
CAS_RN	29360-13-2
FORMULA	C29H34O13
EXACTMASS	590.199941174
AVERAGEMASS	590.57246
SMILES	[C@H](O6)([C@@H](O)[C@@H](O)[C@H](C6CO)O)OC(C(O1)Cc(c25)c1ccc(C(C(C(O5)3)c(c4)c(cc(OC)c4OC)OC3)=O)2)(CO)C
M  END

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