input word = C00056076

Metabolite InformationStructural formula
Name 2-(3,4-Dihydroxy-5-methoxyphenyl)-3,5,7-trihydroxy-1-benzopyrylium(1+)
Petunidin
Formula C16H13O7+
Mw 317.06612777
CAS RN 13270-60-5
C_ID C00056076
InChIKey AFOLOMGWVXKIQL-UHFFFAOYSA-O
InChICode InChI=1S/C16H12O7/c1-22-14-3-7(2-11(19)15(14)21)16-12(20)6-9-10(18)4-8(17)5-13(9)23-16/h2-6H,1H3,(H4-,17,18,19,20,21)/p+1
SMILES COC1=CC(C2=C(O)C=C3C(O)=CC(O)=CC3=[O+]2)=CC(O)=C1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeEricaceaeVaccinium myrtillus Ref.
PlantaeGinkgoaceaeGinkgo biloba Ref.
PlantaePassifloraceaePassiflora quadrangularis Ref.
PlantaeSolanaceaeSolanum tuberosum subsp. Andigena Ref.
--Amonum subulatum Ref.
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