input word = C00042297

Metabolite InformationStructural formula
Name Botryllamide B
Formula C19H17Br2NO4
Mw 480.95243384
CAS RN 163564-65-6
C_ID C00042297 ,
InChIKey VIVASROQEPDEJV-NXFWIZADSA-N
InChICode InChI=1S/C19H17Br2NO4/c1-25-17(11-12-3-5-14(23)6-4-12)19(24)22-8-7-13-9-15(20)18(26-2)16(21)10-13/h3-11,23H,1-2H3,(H,22,24)/b8-7+,17-11+
SMILES c1(c(cc(cc1Br)/C=C/NC(=O)/C(=C\c1ccc(cc1)O)/OC)Br)OC
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
AnimaliaBotryllidaeBotrylloides perspicuum Ref.
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OrganismBotrylloides perspicuum
ReferenceMckay,J.Nat.Prod.,68,(2005),1776