input word = C00063794

Metabolite InformationStructural formula
Name Methylscopolamine
Formula C18H24NO4
Mw 318.17053326
CAS RN 13265-10-6
C_ID C00063794
InChIKey LZCOQTDXKCNBEE-XJMZPCNVSA-N
InChICode InChI=1S/C18H24NO4/c1-19(2)14-8-12(9-15(19)17-16(14)23-17)22-18(21)13(10-20)11-6-4-3-5-7-11/h3-7,12-17,20H,8-10H2,1-2H3/q+1/t12?,13-,14-,15+,16-,17+/m1/s1
SMILES C[N+]1(C)C2CC(OC(=O)C(CO)c3ccccc3)CC1C1OC12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSolanaceaeDatura stramonium Ref.
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