input word = C00060168

Metabolite InformationStructural formula
Name 6,7,7a,8-Tetrahydro-12-hydroxy-11-methoxy-7,7-dimethyl-5H-benzo[g]-1,3-benzodioxolo[6,5,4-de]quinolinium
Formula C20H22NO4
Mw 340.1548832
CAS RN 1605333-10-5
C_ID C00060168
InChIKey PQVMQKAGJGBKQC-UHFFFAOYSA-O
InChICode InChI=1S/C20H21NO4/c1-21(2)7-6-12-9-15-20(25-10-24-15)18-16(12)13(21)8-11-4-5-14(23-3)19(22)17(11)18/h4-5,9,13H,6-8,10H2,1-3H3/p+1
SMILES COc1ccc2c(c1O)-c1c3c(cc4c1C(C2)[N+](C)(C)CC4)OCO3
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMagnoliaceaeMagnolia officinalis Ref.
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