input word = C00053975

Metabolite InformationStructural formula
Name Citrusin D
Formula C16H22O8
Mw 342.13146768
CAS RN 65995-51-9
C_ID C00053975
InChIKey JOIDTHZGWZZGMU-FAOXUISGSA-N
InChICode InChI=1S/C16H22O8/c1-22-11-7-9(4-5-10(11)18)3-2-6-23-16-15(21)14(20)13(19)12(8-17)24-16/h2-5,7,12-21H,6,8H2,1H3/b3-2+/t12-,13-,14+,15-,16-/m1/s1
SMILES COc1cc(/C=C/CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)ccc1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePinaceaePinus sylvestris Ref.
PlantaeRutaceaeCitrus limon Ref.
PlantaeRutaceaeCitrus unshiu Ref.
PlantaeRutaceaeFortunella japonica Ref.
zoom in



OrganismCitrus limon
ReferenceAldrich Library of FT-IR Spectra, 1st edn.,1985, 1, 1124B (ir)