Mol:FL7AADGL0016

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FL7AADGL0016.png 

 
 
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M  STY  1   4 SUP 
M  SLB  1   4   4 
M  SAL   4  2  52  53 
M  SBL   4  1  57 
M  SMT   4  CH2OH 
M  SVB   4 57    3.5358   -2.3754 
M  STY  1   3 SUP 
M  SLB  1   3   3 
M  SAL   3  2  58  59 
M  SBL   3  1  63 
M  SMT   3  OCH3 
M  SVB   3 63     1.989    2.5446 
M  STY  1   2 SUP 
M  SLB  1   2   2 
M  SAL   2  2  56  57 
M  SBL   2  1  61 
M  SMT   2  OCH3 
M  SVB   2 61   -0.3707    2.2559 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  54  55 
M  SBL   1  1  59 
M  SMT   1  OCH3 
M  SVB   1 59     3.844    2.2087 
S  SKP  8 
ID	FL7AADGL0016 
KNApSAcK_ID	C00006864 
NAME	Alatanin 2 
CAS_RN	131189-51-0 
FORMULA	C39H43O20 
EXACTMASS	831.234768816 
AVERAGEMASS	831.7467200000001 
SMILES	C(C(O)1)([C@H]([C@H](O[C@@H](OC[C@@H](O3)[C@@H](C(C(O)[C@@H]3Oc(c6)c([o+1]c(c65)cc(cc5O)O)c(c4)cc(c(c4)O)OC)O)OC(C=Cc(c2)cc(c(c(OC)2)O)OC)=O)1)CO)O)O 
M  END
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