input word = C00025839

Metabolite InformationStructural formula
Name Daurinoline
Formula C37H42N2O6
Mw 610.30428709
CAS RN 2831-75-6
C_ID C00025839 ,
InChIKey APIHNXDZCYDPTF-RFTMCNCJNA-N
InChICode InChI=1S/C37H42N2O6/c1-38-14-12-25-19-33(41)34(42-3)21-28(25)30(38)16-23-6-9-27(10-7-23)45-35-18-24(8-11-32(35)40)17-31-29-22-37(44-5)36(43-4)20-26(29)13-15-39(31)2/h6-11,18-22,30-31,40-41H,12-17H2,1-5H3/t30-,31-/m1/s1
SMILES c1c2[C@H](N(CCc2cc(c1OC)O)C)Cc1ccc(cc1)Oc1c(O)ccc(c1)C[C@H]1N(CCc2c1cc(c(c2)OC)OC)C
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
PlantaeMenispermaceaeMenispermum canadense L. Ref.
PlantaeMenispermaceaeMenispermum dauricum DC. Ref.
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