input word = C00023557

Metabolite InformationStructural formula
Name Deoxynortryptoquivaline
Formula C28H28N4O6
Mw 516.20088466
CAS RN 60676-58-6
C_ID C00023557 ,
InChIKey UQWRSTHNSHDTCA-UHFFFAOYNA-N
InChICode InChI=1S/C28H28N4O6/c1-14(2)22(37-16(4)33)23-30-19-11-7-5-9-17(19)25(35)31(23)21-13-28(38-26(21)36)18-10-6-8-12-20(18)32-24(34)15(3)29-27(28)32/h5-12,14-15,21-22,27,29H,13H2,1-4H3/t15-,21+,22+,27+,28+/m0/s1
SMILES CC(=O)OC(c1nc2ccccc2c(=O)n1C1CC2(OC1=O)c1ccccc1N1C(=O)C(C)NC12)C(C)C
Start Substs in Alk. Biosynthesis (Prediction) Anthranilate
Organism
Kingdom Family Species Reference
FungiTrichocomaceaeAspergillus clavatus Ref.
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