input word = C00027037

Metabolite InformationStructural formula
Name Demethylasterriquinone B1
L 783281
Formula C32H30N2O4
Mw 506.22055746
CAS RN 78860-34-1
C_ID C00027037 ,
InChIKey WOZJOHXTJHXYCW-UHFFFAOYSA-N
InChICode InChI=1S/C32H30N2O4/c1-6-32(4,5)31-23(20-12-7-8-13-21(20)34-31)25-29(37)27(35)24(28(36)30(25)38)22-16-19-11-9-10-18(26(19)33-22)15-14-17(2)3/h6-14,16,33-35,38H,1,15H2,2-5H3
SMILES C1(=C(C(=O)C(=C(C1=O)c1c([nH]c2c1cccc2)C(C=C)(C)C)O)c1cc2c([nH]1)c(ccc2)CC=C(C)C)O
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate
Organism
Kingdom Family Species Reference
FungiHyponectriaceaePseudomassaria sp. Ref.
zoom in