input word = C00026954

Metabolite InformationStructural formula
Name Didemnoline D
Formula C16H14N4OS
Mw 310.08883183
CAS RN 168434-25-1
C_ID C00026954 ,
InChIKey NUHYIZQBMKHEAZ-UHFFFAOYNA-N
InChICode InChI=1S/C16H14N4OS/c1-22(21)16-13(18-10-19-16)9-20-14-5-3-2-4-11(14)12-6-7-17-8-15(12)20/h2-8,10H,9H2,1H3,(H,18,19)/t22-/m0/s1
SMILES c1ccc2c(c1)n(c1c2ccnc1)Cc1[nH]cnc1[S@@](=O)C
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate L-Phe L-His
Organism
Kingdom Family Species Reference
AnimaliaDidemnidaeDidemnum sp. Ref.
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OrganismDidemnum sp.
ReferenceSchumacher,Tetrahedron,51,(1995),10125