input word = C00026969

Metabolite InformationStructural formula
Name Bromotopsentin
Formula C20H13BrN4O2
Mw 420.02218859
CAS RN 112515-44-3
C_ID C00026969
InChIKey YHGQVXFIJGWOFP-UHFFFAOYSA-N
InChICode InChI=1S/C20H13BrN4O2/c21-10-1-3-12-14(7-22-16(12)5-10)18-9-24-20(25-18)19(27)15-8-23-17-6-11(26)2-4-13(15)17/h1-9,22-23,26H,(H,24,25)
SMILES O=C(c1ncc(-c2c[nH]c3cc(Br)ccc23)[nH]1)c1c[nH]c2cc(O)ccc12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AnimaliaHalichondriidaeSpongosorites genitrix Ref.
--Spongosprites sp. Ref.
zoom in



OrganismSpongosprites sp.
ReferenceBao,J.Nat.Prod.,68,(2005),711