input word = C00028790

Metabolite InformationStructural formula
Name Pakistanine
(+)-Pakistanine
Formula C37H40N2O6
Mw 608.28863702
CAS RN 36506-69-1
C_ID C00028790 ,
InChIKey PJBCPYBIOOFQBE-ZTMACLEXNA-N
InChICode InChI=1S/C37H40N2O6/c1-38-12-10-22-16-32(42-3)33(43-4)20-26(22)28(38)14-21-6-8-25(9-7-21)45-31-18-24-15-29-35-23(11-13-39(29)2)17-34(44-5)37(41)36(35)27(24)19-30(31)40/h6-9,16-20,28-29,40-41H,10-15H2,1-5H3/t28-,29+/m0/s1
SMILES c12c(C[C@@H]3c4c1c(c(cc4CCN3C)OC)O)cc(c(c2)O)Oc1ccc(cc1)C[C@@H]1N(CCc2c1cc(c(c2)OC)OC)C
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr L-Phe
Organism
Kingdom Family Species Reference
PlantaeBerberidaceaeBerberis baluchistanica Ref.
PlantaeBerberidaceaeBerberis empetrifolia Ref.
PlantaeBerberidaceaeBerberis waziristanica Ref.
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