input word = C00044451

Metabolite InformationStructural formula
Name 3-Hydroxy-1-methoxy-3-methoxymethylanthraquinone
Formula C17H14O5
Mw 298.08412356
CAS RN 79820-24-9
C_ID C00044451 ,
InChIKey NVVVVKLKMLQLMW-UHFFFAOYSA-N
InChICode InChI=1S/C17H14O5/c1-21-8-12-13(18)7-11-14(17(12)22-2)16(20)10-6-4-3-5-9(10)15(11)19/h3-7,18H,8H2,1-2H3
SMILES c12c(cc(c(c1OC)COC)O)C(=O)c1c(C2=O)cccc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRubiaceaeCoussarea macrophylla Ref.
zoom in