input word = C00024393

Metabolite InformationStructural formula
Name Havanine
Formula C18H25NO5
Mw 335.17327292
CAS RN 72755-23-8
C_ID C00024393 ,
InChIKey RRUFHULZICOXGJ-UHFFFAOYNA-N
InChICode InChI=1S/C18H25NO5/c1-22-10-4-5-18-12-7-13(23-2)16(21)17(24-3)11(12)8-19(9-15(18)20)14(18)6-10/h7,10,14-15,20-21H,4-6,8-9H2,1-3H3/t10-,14+,15+,18+/m0/s1
SMILES COc1cc2c(c(OC)c1O)CN1CC(O)C23CCC(OC)CC13
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr Secologanin
Organism
Kingdom Family Species Reference
PlantaeAmaryllidaceaeHymenocallis arenicola Northrop H Ref.
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