input word = C00040109

Metabolite InformationStructural formula
Name Ptychonal hemiacetal
Formula C20H28O3
Mw 316.20384476
CAS RN 1056678-05-7
C_ID C00040109 ,
InChIKey PELNNQIWPFVKET-UHFFFAOYNA-N
InChICode InChI=1S/C20H28O3/c1-13-5-4-6-17-19(13,3)11-16-14(2)20(17,18(21)23-16)9-7-15-8-10-22-12-15/h5,8,10,12,14,16-18,21H,4,6-7,9,11H2,1-3H3/t14-,16-,17-,18+,19+,20+/m0/s1
SMILES CC1=CCCC2C1(C)CC1OC(O)C2(CCc2ccoc2)C1C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeOlacaceaePtychopetalum olacoides Ref.
zoom in