input word = C00054695

Metabolite InformationStructural formula
Name Cinncassiol C3
Formula C20H30O7
Mw 382.19915331
CAS RN 64979-94-8
C_ID C00054695
InChIKey IJPNDQQOKFKBRG-UHFFFAOYSA-N
InChICode InChI=1S/C20H30O7/c1-10(2)17(24)8-12(21)15(4)9-19(26)16(17,5)14(23)20(27-19)13(22)11(3)6-7-18(15,20)25/h10-11,13,22,24-26H,6-9H2,1-5H3
SMILES CC(C)C1(O)CC(C(C)(CC2(O)O3)C(CCC(C)C4O)(O)C43C(C12C)=O)=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLauraceaeCinnamomum cassia Ref.
zoom in