input word = C00000467

Metabolite InformationStructural formula
Name Isolaurepinnacin
Formula C15H20BrClO
Mw 330.03860587
CAS RN 81053-29-4
C_ID C00000467 ,
InChIKey ZAQAXRPCNVAIRN-YDTICZIGNA-N
InChICode InChI=1S/C15H20BrClO/c1-3-5-6-9-13(17)15-11-8-7-10-14(18-15)12(16)4-2/h1,5-8,12-15H,4,9-11H2,2H3/b6-5+/t12-,13-,14+,15-/m1/s1
SMILES C1=CC[C@H](O[C@H](C1)[C@H](Cl)C/C=C/C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Laurencia pinnata Ref.
zoom in