input word = C00028762

Metabolite InformationStructural formula
Name Okaramine Q
Formula C32H32N4O4
Mw 536.24235554
CAS RN 263905-01-7
C_ID C00028762 ,
InChIKey WVQBDUCUXOANIV-BPFGJQFSNA-N
InChICode InChI=1S/C32H32N4O4/c1-18-29(4,5)35-23-13-9-7-11-21(23)30(39)17-31(40)27(38)34-15-14-28(2,3)25-20(19-10-6-8-12-22(19)33-25)16-24(34)26(37)36(31)32(18,30)35/h6-16,18,33,39-40H,17H2,1-5H3/b15-14-,24-16-/t18-,30-,31+,32+/m0/s1
SMILES c12C(C=CN3C(=Cc1c1c([nH]2)cccc1)C(=O)N1[C@](C3=O)(C[C@]2([C@@]31N(c1c2cccc1)C([C@@H]3C)(C)C)O)O)(C)C
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate L-Ala
Organism
Kingdom Family Species Reference
FungiTrichocomaceaePenicillium simplicissimum Ref.
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OrganismPenicillium simplicissimum
ReferenceShino,Biosci.Biotechnol.Biochem.,64,(2000),103