input word = C00011254

Metabolite InformationStructural formula
Name Okaramine A
(+)-Okaramine A
Formula C32H32N4O3
Mw 520.24744092
CAS RN 115444-43-4
C_ID C00011254 ,
InChIKey XOYCJCSLHCTYSV-IAYCGBGYNA-N
InChICode InChI=1S/C32H32N4O3/c1-6-31(4,5)36-23-14-10-8-12-21(23)32(39)18-25-27(37)34-16-15-30(2,3)26-20(19-11-7-9-13-22(19)33-26)17-24(34)28(38)35(25)29(32)36/h6-17,25,29,33,39H,1,18H2,2-5H3/b16-15-,24-17-/t25-,29+,32-/m1/s1
SMILES c1c2c(ccc1)c1c([nH]2)C(C=CN2C(=C1)C(=O)N1[C@@H](C2=O)C[C@@]2([C@@H]1N(c1c2cccc1)C(C)(C)C=C)O)(C)C
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate
Organism
Kingdom Family Species Reference
FungiTrichocomaceaeAspergillus aculeatus Ref.
FungiTrichocomaceaePenicillium simplicissimum Ref.
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OrganismAspergillus aculeatus
ReferenceHayashi,J.Nat.Prod.,62,(1999),315