input word = C00002314

Metabolite InformationStructural formula
Name Androcymbine
Formula C21H25NO5
Mw 371.17327292
CAS RN 2115-98-2
C_ID C00002314 ,
InChIKey ABMMKLCVJJTPJD-BZIUYQMRNA-N
InChICode InChI=1S/C21H25NO5/c1-22-8-7-21-11-17(26-3)15(23)10-13(21)14(22)6-5-12-9-16(25-2)19(24)20(27-4)18(12)21/h9-11,14,24H,5-8H2,1-4H3/t14-,21+/m0/s1
SMILES c1(c(c2c(cc1OC)CC[C@H]1C3=CC(=O)C(=C[C@@]23CCN1C)OC)OC)O
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr L-Phe
Organism
Kingdom Family Species Reference
PlantaeColchicaceaeAndrocymbium melanthioides Ref.
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