input word = C00016140

Metabolite InformationStructural formula
Name Asterriquinone SU 5504
Formula C32H30N2O4
Mw 506.22055746
CAS RN 226554-36-5
C_ID C00016140 ,
InChIKey IRINREQCDMMSDP-UHFFFAOYSA-N
InChICode InChI=1S/C32H30N2O4/c1-7-31(3,4)22-14-11-13-19-20(16-33-26(19)22)24-27(35)29(37)25(30(38)28(24)36)21-17-34(32(5,6)8-2)23-15-10-9-12-18(21)23/h7-17,33,35,38H,1-2H2,3-6H3
SMILES C=CC(C)(C)c1cccc2c(C3=C(O)C(=O)C(c4cn(C(C)(C)C=C)c5ccccc45)=C(O)C3=O)c[nH]c12
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate
Organism
Kingdom Family Species Reference
FungiTrichocomaceaeAspergillus candidus Ref.
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