input word = C00005850

Metabolite InformationStructural formula
Name Kaempferol 3-(3''-p-coumarylglucoside)
Formula C30H26O13
Mw 594.13734092
CAS RN 74712-68-8
C_ID C00005850 ,
InChIKey VNHVNFCIDMAHID-YYZYPXEBNA-N
InChICode InChI=1S/C30H26O13/c31-13-21-24(37)28(42-22(36)10-3-14-1-6-16(32)7-2-14)26(39)30(41-21)43-29-25(38)23-19(35)11-18(34)12-20(23)40-27(29)15-4-8-17(33)9-5-15/h1-12,21,24,26,28,30-35,37,39H,13H2/b10-3+/t21-,24-,26-,28-,30+/m1/s1
SMILES c1(cc(c2c(c1)oc(c(c2=O)O[C@H]1[C@@H]([C@@H]([C@@H]([C@H](O1)CO)O)OC(=O)/C=C/c1ccc(cc1)O)O)c1ccc(cc1)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePinaceaeLarix leptolepis Ref.
PlantaePinaceaePicea obovata Ref.
zoom in