input word = C00000516

Metabolite InformationStructural formula
Name Ircinal A
(+)-Ircinal A
Formula C26H38N2O2
Mw 410.29332847
CAS RN 139975-55-6
C_ID C00000516 ,
InChIKey VGYIUIBYSYNRNZ-PAHOVPSDNA-N
InChICode InChI=1S/C26H38N2O2/c29-19-21-17-26(30)13-8-4-1-2-5-9-14-27-16-12-23(21)25(20-27)18-22-11-7-3-6-10-15-28(22)24(25)26/h1,4,7,11,17,19,22-24,30H,2-3,5-6,8-10,12-16,18,20H2/b4-1-,11-7-/t22-,23-,24+,25-,26+/m0/s1
SMILES C1=CCCCCN2[C@@H]1C[C@@]13[C@@H]2[C@]2(CC/C=C\CCCCN(CC[C@H]1C(=C2)C=O)C3)O
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys L-Arg
Organism
Kingdom Family Species Reference
AnimaliaIrciniidaeIrcinia sp. Ref.
AnimaliaNiphatidaeAmphimedon sp. Ref.
--Acanthostrongylophora sp. Ref.
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OrganismAmphimedon sp.
ReferenceKobayashi,Tetrahedron,35,(1994),4383

Kondo,J.Org.Chem,57,(1992),2480