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dihydromacarpine

Properties

Image

Occurences in reactions

MNX_ID

MNXM2368

	#reac
in my sandbox	0
in MNXref (generic)	3
in models (compartimentalized)	0

formula

C₂₂H₁₉NO₆

charge

mass

393.395

reference

chebi:18029

InChIKey

RTVFIUBAXAZKSU-UHFFFAOYSA-N

InChI

InChI=1S/C22H19NO6/c1-23-8-14-20(18(25-3)7-19-22(14)29-10-28-19)13-6-15(24-2)11-4-16-17(27-9-26-16)5-12(11)21(13)23/h4-7H,8-10H2,1-3H3

SMILES

[CH3:1][N:23]1[CH2:8][c:14]2[c:20]([c:18]([O:25][CH3:3])[cH:7][c:19]3[c:22]2[O:29][CH2:10][O:28]3)-[c:13]2[cH:6][c:15]([O:24][CH3:2])[c:11]3[cH:4][c:16]4[c:17]([cH:5][c:12]3[c:21]21)[O:27][CH2:9][O:26]4

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:18029 chebi:18029	dihydromacarpine 13,14-Dihydro-5,7-dimethoxy-13-methyl-[1,3]benzodioxolo[5,6-c]-1,3-dioxolo[4,5-i]phenanthridine 13,14-dihydro-5,7-dimethoxy-13-methyl-[1,3]benzodioxolo[5,6-c]-1,3-dioxolo[4,5-i]phenanthridine 5,7-dimethoxy-13-methyl-13,14-dihydro-2H,10H-[1,3]dioxolo[4,5-i][1,3]dioxolo[4',5':4,5]benzo[1,2-c]phenanthridine Dihydromacarpine
seed.compound:cpd03154 seedM:cpd03154	Dihydromacarpine 13,14-Dihydro-5,7-dimethoxy-13-methyl-[1,3]benzodioxolo[5,6-c]-1,3- dioxolo[4,5-i]phenanthridine 13,14-Dihydro-5,7-dimethoxy-13-methyl-[1,3]benzodioxolo[5,6-c]-1,3-dioxolo[4,5-i]phenanthridine dihydromacarpine
kegg.compound:C05316 keggC:C05316	Dihydromacarpine 13,14-Dihydro-5,7-dimethoxy-13-methyl-[1,3]benzodioxolo[5,6-c]-1,3-dioxolo[4,5-i]phenanthridine
metacyc.compound:DIHYDROMACARPINE metacycM:DIHYDROMACARPINE	dihydromacarpine
chebi:14156 chebi:23753 chebi:4571 keggC:M_C05316 seedM:M_cpd03154	secondary/obsolete/fantasy identifier