input word = C00006695

Metabolite InformationStructural formula
Name 6-Hydroxycyanidin 3-rutinoside
Formula C27H31O16
Mw 611.16120995
CAS RN 99124-25-1
C_ID C00006695 ,
InChIKey TZAVOGUPJPOVFA-KFFORHMJNA-O
InChICode InChI=1S/C27H30O16/c1-8-17(31)21(35)23(37)26(40-8)39-7-16-20(34)22(36)24(38)27(43-16)42-15-5-10-14(6-13(30)19(33)18(10)32)41-25(15)9-2-3-11(28)12(29)4-9/h2-6,8,16-17,20-24,26-27,31,34-38H,7H2,1H3,(H4-,28,29,30,32,33)/p+1/t8-,16+,17-,20+,21-,22+,23+,24+,26+,27+/m0/s1
SMILES c1(c(c(c2c(c1)[o+]c(c(c2)O[C@H]1[C@@H]([C@@H]([C@@H]([C@H](O1)CO[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)C)O)O)O)O)O)O)c1ccc(c(c1)O)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAlstroemeriaceaeAlstroemeria aurantiaca Ref.
PlantaeAlstroemeriaceaeAlstroemeria ligtu Ref.
PlantaeAlstroemeriaceaeAlstroemeria pulchella Ref.
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OrganismAlstroemeria pulchella
ReferenceHarborne, The Handbook of Natural Flavonoids, 2, (1999), 1,Anthocyanins

Saito,Phytochem.,24,(1985),2125

Saito,Phytochem.,27,(1988),1399