input word = C00034440

Metabolite InformationStructural formula
Name Asterelin B
Formula C29H24O4
Mw 436.16745925
CAS RN 945962-35-6
C_ID C00034440 ,
InChIKey CLHRCNCUQXINHL-UHFFFAOYSA-N
InChICode InChI=1S/C29H24O4/c1-31-25-13-8-20-3-2-19-7-12-24-26(14-19)33-28-17-22(30)16-21(29(24)28)9-4-18-5-10-23(11-6-18)32-27(25)15-20/h5-8,10-17,30H,2-4,9H2,1H3
SMILES c1(cc2c3c(c1)CCc1ccc(cc1)Oc1cc(ccc1OC)CCc1cc(c3cc1)o2)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAytoniaceaeAsterella angusta Ref.
zoom in