input word = C00031691

Metabolite InformationStructural formula
Name Corynantheidaline
Formula C21H22N2O3
Mw 350.16304258
CAS RN 132922-57-7
C_ID C00031691 ,
InChIKey ZGSKSGGZSIKMEC-GNGOCYKWNA-N
InChICode InChI=1S/C21H22N2O3/c1-3-13-11-23-9-8-15-14-6-4-5-7-18(14)22-20(15)19(23)10-16(13)17(12-24)21(25)26-2/h4-7,10,12-13,22H,3,8-9,11H2,1-2H3/b17-16-/t13-/m1/s1
SMILES c1ccc2c(c1)c1c([nH]2)C2=C/C(=C(/C(=O)OC)\C=O)/[C@@H](CN2CC1)CC
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Secologanin
Organism
Kingdom Family Species Reference
PlantaeRubiaceaeMitragyna speciosa Ref.
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OrganismMitragyna speciosa
ReferenceTakayama,Chem.Pharm.Bull.,52,(2004),916