input word = C00060167

Metabolite InformationStructural formula
Name (6aS)-5,6,6a,7-Tetrahydro-1,11-dihydroxy-2,10-dimethoxy-6,6-dimethyl-4-oxo-4H-dibenzo[de,g]quinolinium
Formula C20H22NO5
Mw 356.14979782
CAS RN 1605333-03-6
C_ID C00060167
InChIKey LQWPWWQQRDNWAH-LBPRGKRZSA-O
InChICode InChI=1S/C20H21NO5/c1-21(2)9-13(22)11-8-15(26-4)20(24)18-16-10(7-12(21)17(11)18)5-6-14(25-3)19(16)23/h5-6,8,12H,7,9H2,1-4H3,(H-,22,23,24)/p+1/t12-/m0/s1
SMILES COc1ccc2c(c1O)-c1c(O)c(OC)cc3c1C(C2)[N+](C)(C)CC3=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMagnoliaceaeMagnolia officinalis Ref.
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OrganismMagnolia officinalis
Referencehttps://doi.org/10.3390/molecules18077739