input word = C00026698

Metabolite InformationStructural formula
Name Pityriarubin B
Formula C32H20N4O4
Mw 524.14845516
CAS RN 454475-84-4
C_ID C00026698 ,
InChIKey VAARBHPRZVWJLJ-UHFFFAOYSA-N
InChICode InChI=1S/C32H20N4O4/c37-28-27(21-15-35-24-12-6-3-9-18(21)24)32(36-31(28)40)29(38)25(19-13-33-22-10-4-1-7-16(19)22)26(30(32)39)20-14-34-23-11-5-2-8-17(20)23/h1-15,33-35,37H,(H,36,40)
SMILES O=C1NC2(C(=O)C(c3c[nH]c4ccccc34)=C(c3c[nH]c4ccccc34)C2=O)C(c2c[nH]c3ccccc23)=C1O
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate
Organism
Kingdom Family Species Reference
--Malassezia furfur Ref.
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OrganismMalassezia furfur
ReferenceIrlinger,Angew.Chem.Int.Ed.,43,(2004),1098