input word = C00054707

Metabolite InformationStructural formula
Name Aceronidin
Formula C21H22O11
Mw 450.11621155
CAS RN 894078-20-7
C_ID C00054707
InChIKey WMTIAYYAPVISNW-WNHXRGPRSA-N
InChICode InChI=1S/C21H22O11/c22-6-13-15(27)16(28)19-21(30-13)32-20-17(7-1-2-9(24)10(25)3-7)29-12-5-8(23)4-11(26)14(12)18(20)31-19/h1-5,13,15-28H,6H2/t13-,15-,16+,17-,18+,19-,20-,21+/m1/s1
SMILES OC[C@H]1O[C@H]2O[C@@H]3[C@@H](c4ccc(O)c(O)c4)Oc4cc(O)cc(O)c4[C@@H]3O[C@@H]2[C@@H](O)[C@@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMalpighiaceaeMalpighia emarginata Ref.
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