input word = C00043971

Metabolite InformationStructural formula
Name Tetradehydrohalicyclamine A
Formula C32H47N2
Mw 459.37392451
CAS RN 787551-24-0
C_ID C00043971 ,
InChIKey CGRONGUKPBFBLD-IPYHSMNUNA-N
InChICode InChI=1S/C32H47N2/c1-2-5-10-14-18-23-34-26-29-19-15-11-7-4-6-9-13-17-22-33-24-21-32(31(25-29)28-34)30(27-33)20-16-12-8-3-1/h1-2,4,6,9-10,13-14,25-26,28,30,32H,3,5,7-8,11-12,15-24,27H2/b2-1-,6-4-,13-9+,14-10-/t30-,32-/m1/s1
SMILES c12cc3cn(c1)CC/C=C\C/C=C\CCCCC[C@H]1[C@H]3CCN(C1)CC/C=C/C=C\CCCC2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AnimaliaNiphatidaeAmphimedon sp. Ref.
zoom in