input word = C00047889

Metabolite InformationStructural formula
Name Flustramine N
(-)-Flustramine N
Formula C21H29BrN2O
Mw 404.14632646
CAS RN 1187956-29-1
C_ID C00047889 ,
InChIKey SQMRGQPMSRIJKQ-UHFFFAOYNA-N
InChICode InChI=1S/C21H29BrN2O/c1-13(2)6-7-15-12-16(22)18(23)17-19(15)25-20-21(17,9-8-14(3)4)10-11-24(20)5/h6,8,12,20H,7,9-11,23H2,1-5H3/t20-,21-/m1/s1
SMILES c1c(c(c2c(c1CC=C(C)C)O[C@@H]1[C@@]2(CCN1C)CC=C(C)C)N)Br
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
--Flustra foliacea Ref.
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