input word = C00000585

Metabolite InformationStructural formula
Name Guaiaretic acid
Formula C20H24O4
Mw 328.16745925
CAS RN 500-40-3
C_ID C00000585 ,
InChIKey OPAORDVBZRVVNQ-UKTHLTGXNA-N
InChICode InChI=1S/C20H24O4/c1-13(9-15-5-7-17(21)19(11-15)23-3)14(2)10-16-6-8-18(22)20(12-16)24-4/h5-9,11-12,14,21-22H,10H2,1-4H3/b13-9+/t14-/m1/s1
SMILES c1(c(ccc(c1)C[C@H](/C(=C/c1ccc(c(c1)OC)O)/C)C)O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeZygophyllaceaeGuaiacum officinale Ref.
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