input word = C00006655

Metabolite InformationStructural formula
Name Cyanidin 3-lathyroside
Formula C26H29O15
Mw 581.15064526
CAS RN 31073-32-2
C_ID C00006655 ,
InChIKey ZPPQIOUITZSYAO-WCJQWBAWNA-O
InChICode InChI=1S/C26H28O15/c27-7-18-20(34)21(35)24(41-25-22(36)19(33)15(32)8-37-25)26(40-18)39-17-6-11-13(30)4-10(28)5-16(11)38-23(17)9-1-2-12(29)14(31)3-9/h1-6,15,18-22,24-27,32-36H,7-8H2,(H3-,28,29,30,31)/p+1/t15-,18-,19-,20-,21-,22-,24+,25-,26+/m0/s1
SMILES c1(cc(c2c(c1)[o+]c(c(c2)O[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)CO)O)O)O[C@H]1[C@H]([C@H]([C@H](CO1)O)O)O)c1ccc(c(c1)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeDaucus carota Ref.
PlantaeAraliaceaeAralia cordata Ref.
PlantaeAraliaceaeAralia elata Ref.
PlantaeAraliaceaeFatsia japonica Ref.
PlantaeEricaceaeCyathodes dealbata Ref.
PlantaeFabaceaeLathyrus odoratus Ref.
zoom in