input word = C00031112

Metabolite InformationStructural formula
Name Purpuramine H
Formula C21H24Br3N3O4
Mw 618.93169498
CAS RN 149636-99-7
C_ID C00031112 ,
InChIKey QQOOTUXDNKJQSN-OVVQPSECSA-N
InChICode InChI=1S/C21H24Br3N3O4/c1-30-19-4-3-13(9-15(19)22)12-18(27-29)21(28)26-7-5-14-10-16(23)20(17(24)11-14)31-8-2-6-25/h3-4,9-11,29H,2,5-8,12,25H2,1H3,(H,26,28)/b27-18+
SMILES c1(c(cc(cc1Br)CCNC(=O)/C(=N/O)/Cc1cc(c(cc1)OC)Br)Br)OCCCN
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
--Psammaplysilla purpurea Ref.
--Suberea sp. Ref.
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