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(S)-cis-N-methylstylopine

Properties

Image

Occurences in reactions

MNX_ID

MNXM31809

	#reac
in my sandbox	0
in MNXref (generic)	5
in models (compartimentalized)	0

formula

C₂₀H₂₀NO₄

charge

mass

338.13868

reference

chebi:444

InChIKey

GBUUKFRQPCPYPW-KKSFZXQISA-N

InChI

InChI=1S/C20H20NO4/c1-21-5-4-13-7-18-19(24-10-23-18)8-14(13)16(21)6-12-2-3-17-20(15(12)9-21)25-11-22-17/h2-3,7-8,16H,4-6,9-11H2,1H3/q+1/t16-,21-/m0/s1

SMILES

C[N@@+]12CCc3cc4c(cc3[C@@H]1Cc1ccc3c(c1C2)OCO3)OCO4

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:444 chebi:444	(S)-cis-N-methylstylopine (5S,12bS)-5-methyl-6,7,12b,13-tetrahydro-4H-[1,3]dioxolo[4,5-g][1,3]dioxolo[7,8]isoquino[3,2-a]isoquinolin-5-ium
kegg.compound:C06163 keggC:C06163	(S)-cis-N-Methylstylopine
metacyc.compound:CPD-7846 metacycM:CPD-7846	(S)-cis-N-methylstylopine
seed.compound:cpd03678 seedM:cpd03678	(S)-cis-N-methylstylopine (S)-cis-N-Methylstylopine
keggC:M_C06163 seedM:M_cpd03678	secondary/obsolete/fantasy identifier