input word = C00024606

Metabolite InformationStructural formula
Name Tetrahydrosecodine
Formula C21H30N2O2
Mw 342.23072822
CAS RN 27498-98-2
C_ID C00024606 ,
InChIKey MDMQSLUDGHJHNV-UHFFFAOYNA-N
InChICode InChI=1S/C21H30N2O2/c1-4-16-8-7-12-23(14-16)13-11-18-17-9-5-6-10-19(17)22-20(18)15(2)21(24)25-3/h5-6,9-10,15-16,22H,4,7-8,11-14H2,1-3H3/t15-,16+/m1/s1
SMILES CCC1CCCN(CCc2c(C(C)C(=O)OC)[nH]c3ccccc23)C1
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Secologanin
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeAspidosperma marcgravianum Ref.
PlantaeApocynaceaeRhazya sticta Ref.
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