input word = C00040494

Metabolite InformationStructural formula
Name Tiruchanduramine
Formula C17H18N6O
Mw 322.15420924
CAS RN 858343-35-8
C_ID C00040494 ,
InChIKey YGFACAUGZLLRPQ-UHFFFAOYNA-N
InChICode InChI=1S/C17H18N6O/c18-17-21-8-10(22-17)5-6-19-16(24)14-7-12-11-3-1-2-4-13(11)23-15(12)9-20-14/h1-4,7,9-10,23H,5-6,8H2,(H,19,24)(H3,18,21,22)/t10-/m0/s1
SMILES c12c(c3c([nH]1)cnc(c3)C(=O)NCC[C@H]1CN=C(N1)N)cccc2
Start Substs in Alk. Biosynthesis (Prediction) L-Trp
Organism
Kingdom Family Species Reference
AnimaliaDidemnidaeDidemnum sp. Ref.
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OrganismDidemnum sp.
ReferenceKearns,J.Nat.Prod.,71,(2008),1280