input word = C00042159

Metabolite InformationStructural formula
Name 6-Bromo-1'-ethoxy-1',8-dihydroaplysinopsin
(+)-6-Bromo-1'-ethoxy-1',8-dihydroaplysinopsin
Formula C16H19BrN4O2
Mw 378.06913878
CAS RN 868830-20-0
C_ID C00042159 ,
InChIKey RNZDQSFDNPIZJE-UHFFFAOYNA-N
InChICode InChI=1S/C16H19BrN4O2/c1-4-23-16(14(22)20(2)15(18)21(16)3)8-10-9-19-13-7-11(17)5-6-12(10)13/h5-7,9,18-19H,4,8H2,1-3H3/b18-15+/t16-/m1/s1
SMILES CCOC1(Cc2c[nH]c3cc(Br)ccc23)C(=O)N(C)C(=N)N1C
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
--Smenospongia sp. specimen (UCSC coll.no.91111) Ref.
--Thorectandra sp. NCI coll.no.0CDN5714 Ref.
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