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Mol:FLIA1ADS0001 - Revision history
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Copyright: ARM project http://www.metabolome.jp/<br />
41 45 0 0 0 0 0 0 0 0999 V2000<br />
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10 5 1 0 0 0 0<br />
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32 38 1 0 0 0 0<br />
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18 40 1 0 0 0 0<br />
40 41 1 0 0 0 0<br />
M STY 1 1 SUP<br />
M SLB 1 1 1<br />
M SAL 1 2 38 39<br />
M SBL 1 1 42<br />
M SMT 1 CH2OH<br />
M SBV 1 42 -8.2616 5.6074<br />
M STY 1 2 SUP<br />
M SLB 1 2 2<br />
M SAL 2 2 40 41<br />
M SBL 2 1 44<br />
M SMT 2 CH2OH<br />
M SBV 2 44 -7.8307 6.7969<br />
S SKP 8<br />
ID FLIA1ADS0001<br />
KNApSAcK_ID C00006228<br />
NAME Puerarin 4'-O-glucoside<br />
CAS_RN 117047-08-2<br />
FORMULA C27H30O14<br />
EXACTMASS 578.163555668<br />
AVERAGEMASS 578.5187000000001<br />
SMILES C(C5O)(CO)OC(C(O)C5O)c(c41)c(O)ccc1C(C(=CO4)c(c3)ccc(c3)OC(O2)C(O)C(O)C(O)C2CO)=O<br />
M END<br />
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