input word = C00026699

Metabolite InformationStructural formula
Name Pityriarubin C
Formula C32H19N3O5
Mw 525.13247074
CAS RN 454475-86-6
C_ID C00026699 ,
InChIKey HODDPEOUHGCZAP-UHFFFAOYSA-N
InChICode InChI=1S/C32H19N3O5/c36-28-27(21-15-35-24-12-6-3-9-18(21)24)32(40-31(28)39)29(37)25(19-13-33-22-10-4-1-7-16(19)22)26(30(32)38)20-14-34-23-11-5-2-8-17(20)23/h1-15,33-36H
SMILES O=C1OC2(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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