input word = C00026188

Metabolite InformationStructural formula
Name Echihumiline
Formula C20H31NO7
Mw 397.21005235
CAS RN 174285-73-5
C_ID C00026188 ,
InChIKey XQRINBJLKOBTMI-JJYTYGBTNA-N
InChICode InChI=1S/C20H31NO7/c1-12(2)10-16(23)28-15-7-9-21-8-6-14(17(15)21)11-27-18(24)20(26,13(3)22)19(4,5)25/h6,10,13,15,17,22,25-26H,7-9,11H2,1-5H3/t13-,15+,17+,20-/m0/s1
SMILES CC(C)=CC(=O)O[C@@H]1CCN2CC=C(COC(=O)[C@@](O)([C@H](C)O)C(C)(C)O)[C@H]12
Start Substs in Alk. Biosynthesis (Prediction) L-Arg L-Asp Cholesterol
Organism
Kingdom Family Species Reference
PlantaeBoraginaceaeEchium vulgare Ref.
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