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Mol:FL7AAHGL0011 - Revision history
2026-05-16T06:12:07Z
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Copyright: ARM project http://www.metabolome.jp/<br />
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M STY 1 1 SUP<br />
M SLB 1 1 1<br />
M SAL 1 2 44 45<br />
M SBL 1 1 48<br />
M SMT 1 OCH3<br />
M SVB 1 48 -0.8311 3.0289<br />
S SKP 8<br />
ID FL7AAHGL0011<br />
KNApSAcK_ID C00006896<br />
NAME Petunidin 3-(6''-p-coumarylglucoside)<br />
CAS_RN 51939-69-6,71991-89-4<br />
FORMULA C31H29O14<br />
EXACTMASS 625.155730636<br />
AVERAGEMASS 625.5535600000001<br />
SMILES C(c(c5)ccc(O)c5)=CC(OC[C@H]([C@H](O)4)O[C@H](C(O)C4O)Oc(c1)c(c(c3)cc(O)c(O)c3OC)[o+1]c(c2)c(c(O)cc2O)1)=O<br />
M END<br />
</pre></div>
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