input word = C00006663

Metabolite InformationStructural formula
Name Cyanidin 3-arabinoside-5-glucoside
Formula C26H29O15
Mw 581.15064526
CAS RN
C_ID C00006663 ,
InChIKey RDPDRUIPCDMFNQ-KVZKOCCENA-O
InChICode InChI=1S/C26H28O15/c27-7-18-20(33)21(34)23(36)26(41-18)39-16-5-10(28)4-15-11(16)6-17(40-25-22(35)19(32)14(31)8-37-25)24(38-15)9-1-2-12(29)13(30)3-9/h1-6,14,18-23,25-27,31-36H,7-8H2,(H2-,28,29,30)/p+1/t14-,18+,19-,20+,21-,22-,23+,25-,26+/m0/s1
SMILES OCC1O[C@@H](Oc2cc(O)cc3[o+]c(-c4ccc(O)c(O)c4)c(O[C@@H]4OC[C@H](O)C(O)C4O)cc23)C(O)[C@@H](O)[C@@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeEricaceaeRhododendron simsii Ref.
PlantaePolygonaceaePolygonum spp. Ref.
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