input word = C00045755

Metabolite InformationStructural formula
Name Cespitularin D
(-)-Cespitularin D
Formula C20H28O4
Mw 332.19875938
CAS RN 473911-40-9
C_ID C00045755 ,
InChIKey NAXRGDYBDAKNAZ-RAXLEYEMNA-N
InChICode InChI=1S/C20H28O4/c1-12-5-6-14-7-8-16-17(19(14,3)4)20(23,24-18(16)22)11-13(2)10-15(21)9-12/h10,14-15,21,23H,1,5-9,11H2,2-4H3/b13-10+/t14-,15+,20-/m0/s1
SMILES C12=C3CC[C@@H](C1(C)C)CCC(=C)C[C@H](/C=C(/C[C@@]2(OC3=O)O)\C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AnimaliaXeniidaeCespitularia hypotentaculata Ref.
zoom in