input word = C00029647

Metabolite InformationStructural formula
Name AG-3
Formula C31H25N3O
Mw 455.19976244
CAS RN 52831-33-1
C_ID C00029647 ,
InChIKey RZORRJZIYMHCKZ-UHFFFAOYSA-N
InChICode InChI=1S/C31H25N3O/c35-31(21-10-2-1-3-11-21)34-28-17-9-4-12-22(28)18-25(29-19-23-13-5-7-15-26(23)32-29)30-20-24-14-6-8-16-27(24)33-30/h1-17,19-20,25,32-33H,18H2,(H,34,35)
SMILES C(Cc1c(cccc1)NC(=O)c1ccccc1)(c1[nH]c2c(c1)cccc2)c1cc2c([nH]1)cccc2
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate
Organism
Kingdom Family Species Reference
AnimaliaAcanthasteridaeAcanthaster planci Ref.
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