input word = C00059921

Metabolite InformationStructural formula
Name Petunidin chloride
Formula C16H13ClO7
Mw 352.03498048
CAS RN 1429-30-7
C_ID C00059921
InChIKey QULMBDNPZCFSPR-UHFFFAOYSA-N
InChICode InChI=1S/C16H12O7.ClH/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);1H
SMILES COc1cc(-c2[o+]c3cc(O)cc(O)c3cc2O)cc(O)c1O.[Cl-]
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeCatharanthus roseus Ref.
PlantaeCruciferaeRaphanus sativus Ref.
PlantaeFabaceaePhaseolus vulgaris Ref.
PlantaeRosaceaePrunus avium Ref.
PlantaeSolanaceaeSolanum tuberosum Ref.
zoom in