input word = C00005131

Metabolite InformationStructural formula
Name Datiscin
Formula C27H30O15
Mw 594.15847029
CAS RN 16310-92-2
C_ID C00005131 ,
InChIKey BJJCTXDEJUWVIC-FBSNBPALNA-N
InChICode InChI=1S/C27H30O15/c1-9-17(31)20(34)22(36)26(39-9)38-8-15-18(32)21(35)23(37)27(41-15)42-25-19(33)16-13(30)6-10(28)7-14(16)40-24(25)11-4-2-3-5-12(11)29/h2-7,9,15,17-18,20-23,26-32,34-37H,8H2,1H3/t9-,15+,17-,18+,20-,21-,22-,23+,26+,27-/m0/s1
SMILES CC1O[C@@H](OCC2O[C@@H](Oc3c(-c4ccccc4O)oc4cc(O)cc(O)c4c3=O)C(O)C(O)[C@@H]2O)C(O)[C@@H](O)[C@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeDatiscaceaeDatisca cannabina Ref.
zoom in



OrganismDatisca cannabina
ReferenceHarborne, The Handbook of Natural Flavonoids, 1, (1999), 297.Flavonol O-glycosides

Griesbach, Phytochem.,7,(1968),51

Zapesochnaya,Khim.Prir.Soedin,(1982),180