input word = C00034439

Metabolite InformationStructural formula
Name Asterelin A
Formula C28H22O4
Mw 422.15180919
CAS RN 945962-34-5
C_ID C00034439 ,
InChIKey UYYGENBVWBZOIM-UHFFFAOYSA-N
InChICode InChI=1S/C28H22O4/c29-21-15-20-8-3-17-4-9-22(10-5-17)31-26-14-19(7-12-24(26)30)2-1-18-6-11-23-25(13-18)32-27(16-21)28(20)23/h4-7,9-16,29-30H,1-3,8H2
SMILES c1(cc2c3c(c1)CCc1ccc(cc1)Oc1cc(ccc1O)CCc1cc(c3cc1)o2)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAytoniaceaeAsterella angusta Ref.
zoom in