Mol:FL1DA9NM0006

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Copyright: ARM project http://www.metabolome.jp/
 21 22  0  0  0  0  0  0  0  0999 V2000
    2.3913   -0.4763    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0579   -0.0914    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0579    0.6783    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3913    1.0631    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7247    0.6783    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7247   -0.0914    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0166   -0.5003    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2672   -0.0676    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4568   -0.4857    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1438   -0.0890    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1438    0.6952    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8230    1.0874    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5022    0.6952    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5022   -0.0890    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8230   -0.4812    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4568   -1.0874    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0344    1.0025    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0579   -0.4099    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8230   -1.0703    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5452    1.0408    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1693    0.6283    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 10  1  0  0  0  0
  9 16  2  0  0  0  0
 13 17  1  0  0  0  0
 14 18  1  0  0  0  0
 15 19  1  0  0  0  0
 11 20  1  0  0  0  0
 20 21  1  0  0  0  0
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  20  21
M  SBL   1  1  21
M  SMT   1 OCH3
M  SBV   1 21   -7.8423    5.4958
S  SKP  8
ID	FL1DA9NM0006
KNApSAcK_ID	C00008117
NAME	2',4'-Dihydroxy-6'-methoxy-3'-methyldihydrochalcone;Myrigalone H
CAS_RN	143502-00-5
FORMULA	C17H18O4
EXACTMASS	286.120509064
AVERAGEMASS	286.32241999999997
SMILES	COc(c1)c(C(=O)CCc(c2)cccc2)c(O)c(C)c(O)1
M  END

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