input word = C00028760

Metabolite InformationStructural formula
Name Okaramine O
Formula C32H34N4O4
Mw 538.2580056
CAS RN 244071-76-9
C_ID C00028760 ,
InChIKey AGEIPFHTGOFAIQ-FZOHLBFXNA-N
InChICode InChI=1S/C32H34N4O4/c1-6-31(4,5)36-21-14-10-8-12-19(21)32(40)17-22-27(38)34-16-15-30(2,3)26-23(18-11-7-9-13-20(18)33-26)25(37)24(34)28(39)35(22)29(32)36/h6-16,22,24-25,29,33,37,40H,1,17H2,2-5H3/b16-15-/t22-,24-,25+,29+,32-/m0/s1
SMILES C=CC(C)(C)N1c2ccccc2[C@@]2(O)C[C@H]3C(=O)N4/C=CC(C)(C)c5[nH]c6ccccc6c5[C@@H](O)[C@H]4C(=O)N3[C@@H]12
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate L-Ala
Organism
Kingdom Family Species Reference
FungiTrichocomaceaePenicillium simplicissimum Ref.
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