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Mol:FL5FAAGL0051 - Revision history
2026-09-30T07:13:15Z
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Copyright: ARM project http://www.metabolome.jp/<br />
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53 54 1 0 0 0 0<br />
M STY 1 3 SUP<br />
M SLB 1 3 3<br />
M SAL 3 2 53 54<br />
M SBL 3 1 58<br />
M SMT 3 CH2OH<br />
M SVB 3 58 -3.7633 -0.6852<br />
M STY 1 2 SUP<br />
M SLB 1 2 2<br />
M SAL 2 2 51 52<br />
M SBL 2 1 56<br />
M SMT 2 CH2OH<br />
M SVB 2 56 4.2332 -0.6664<br />
M STY 1 1 SUP<br />
M SLB 1 1 1<br />
M SAL 1 2 49 50<br />
M SBL 1 1 54<br />
M SMT 1 CH2OH<br />
M SVB 1 54 -3.7484 1.1621<br />
S SKP 8<br />
ID FL5FAAGL0051<br />
KNApSAcK_ID C00005248<br />
NAME Kaempferol 3-glucoside-7-sophoroside<br />
CAS_RN 135264-85-6<br />
FORMULA C33H40O21<br />
EXACTMASS 772.206208342<br />
AVERAGEMASS 772.6581<br />
SMILES OC(C(O)1)[C@@H](O)[C@@H](CO)O[C@H]1OC(=C5c(c6)ccc(O)c6)C(=O)c(c2O)c(O5)cc(O[C@@H]([C@@H](O[C@@H]([C@@H](O)4)OC(CO)[C@H](O)[C@H](O)4)3)OC(CO)[C@H](O)[C@H](O)3)c2<br />
M END<br />
</pre></div>
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