input word = C00042161

Metabolite InformationStructural formula
Name 6-Bromo-1'-methoxy-1,8-dihydroaplysinopsin
(+)-6-Bromo-1'-methoxy-1,8-dihydroaplysinopsin
Formula C15H17BrN4O2
Mw 364.05348872
CAS RN 868830-19-7
C_ID C00042161 ,
InChIKey QGMVWWCRCSOHMZ-UHFFFAOYNA-N
InChICode InChI=1S/C15H17BrN4O2/c1-19-13(21)15(22-3,20(2)14(19)17)7-9-8-18-12-6-10(16)4-5-11(9)12/h4-6,8,17-18H,7H2,1-3H3/b17-14+/t15-/m1/s1
SMILES COC1(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
--Thorectandra sp. NCI coll.no.0CDN5714 Ref.
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