Mol:FL7AECGL0001

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 33 36  0  0  0  0  0  0  0  0999 V2000 
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    3.0561   -3.2023    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
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  4  7  1  0  0  0  0 
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 32 33  1  0  0  0  0 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  32  33 
M  SBL   1  1  35 
M  SMT   1  CH2OH 
M  SVB   1 35    2.5301   -1.7123 
S  SKP  8 
ID	FL7AECGL0001 
KNApSAcK_ID	C00006694 
NAME	6-Hydroxycyanidin 3-glucoside 
CAS_RN	99124-24-0,478693-93-5 
FORMULA	C21H21O12 
EXACTMASS	465.103301136 
AVERAGEMASS	465.38424 
SMILES	C([C@@H]1Oc(c(c(c4)cc(c(O)c4)O)2)cc(c(O)3)c(cc(O)c3O)[o+1]2)(O)C(O)[C@@H](O)[C@H](O1)CO 
M  END