input word = C00021840

Metabolite InformationStructural formula
Name Isoquadrone
Formula C15H20O3
Mw 248.1412445
CAS RN 81130-69-0
C_ID C00021840 ,
InChIKey SEETYEZEEVLMJA-BGGWNGSMNA-N
InChICode InChI=1S/C15H20O3/c1-13(2)7-15-9-5-4-8(13)10(15)6-11(16)14(15,3)18-12(9)17/h8-10H,4-7H2,1-3H3/t8-,9?,10-,14?,15+/m1/s1
SMILES CC1(C)CC23[C@@H]4CC(=O)[C@]2(C)OC(=O)[C@@H]3CC[C@H]41
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiTrichocomaceaeAspergillus terreus Ref.
zoom in