Mol:FL3FELNS0006

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Copyright: ARM project http://www.metabolome.jp/
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M  STY  1   7 SUP
M  SLB  1   7   7
M  SAL   7  2  30  31
M  SBL   7  1  32
M  SMT   7  OCH3
M  SVB   7 32    1.3907    1.7079
M  STY  1   6 SUP
M  SLB  1   6   6
M  SAL   6  2  28  29
M  SBL   6  1  30
M  SMT   6  OCH3
M  SVB   6 30   -2.5983    0.4474
M  STY  1   5 SUP
M  SLB  1   5   5
M  SAL   5  2  26  27
M  SBL   5  1  28
M  SMT   5  OCH3
M  SVB   5 28   -2.9555   -0.7222
M  STY  1   4 SUP
M  SLB  1   4   4
M  SAL   4  2  24  25
M  SBL   4  1  26
M  SMT   4  OCH3
M  SVB   4 26   -2.1212   -1.2954
M  STY  1   3 SUP
M  SLB  1   3   3
M  SAL   3  2  22  23
M  SBL   3  1  24
M  SMT   3  OCH3
M  SVB   3 24     0.183    1.4232
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  20  21
M  SBL   2  1  22
M  SMT   2  OCH3
M  SVB   2 22    1.8838   -0.0565
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  18  19
M  SBL   1  1  20
M  SMT   1  OCH3
M  SVB   1 20     2.241    1.1317
S  SKP  8
ID	FL3FELNS0006
KNApSAcK_ID	C00003979
NAME	Agehoustin B
CAS_RN	87402-97-9
FORMULA	C22H24O9
EXACTMASS	432.14203236599997
AVERAGEMASS	432.42056
SMILES	O(C)c(c3OC)cc(c(c(OC)3)1)OC(c(c2)c(OC)c(OC)c(OC)c(OC)2)=CC(=O)1
M  END

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