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(S)-scoulerine

Properties

Image

Occurences in reactions

MNX_ID

MNXM1302

	#reac
in my sandbox	0
in MNXref (generic)	14
in models (compartimentalized)	0

formula

C₁₉H₂₁NO₄

charge

mass

327.14706

reference

InChIKey

KNWVMRVOBAFFMH-HNNXBMFYSA-N

InChI

InChI=1S/C19H21NO4/c1-23-17-4-3-11-7-15-13-9-16(21)18(24-2)8-12(13)5-6-20(15)10-14(11)19(17)22/h3-4,8-9,15,21-22H,5-7,10H2,1-2H3/t15-/m0/s1

SMILES

COc1cc2c(cc1O)[C@@H]1Cc3ccc(OC)c(O)c3CN1CC2

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:17129 chebi:17129	(S)-scoulerine (-)-scoulerine (13aS)-3,10-dimethoxy-5,8,13,13a-tetrahydro-6H-isoquino[3,2-a]isoquinoline-2,9-diol (13aS)-5,8,13,13a-tetrahydro-3,10-dimethoxy-6H-dibenzo[a,g]quinolizine-2,9-diol (S)-Scoulerine
seed.compound:cpd01427 seedM:cpd01427	(S)-Scoulerine (-)-scoulerine (13aS)-3,10-dimethoxy-5,8,13,13a-tetrahydro-6H-isoquino[3,2-a]isoquinoline-2,9-diol (13aS)-5,8,13,13a-Tetrahydro-3,10-dimethoxy-6H-dibenzo[a,g]quinolizine-2,9-diol (13aS)-5,8,13,13a-tetrahydro-3,10-dimethoxy-6H- dibenzo[a,g]quinolizine-2,9-diol (13aS)-5,8,13,13a-tetrahydro-3,10-dimethoxy-6H-dibenzo[a,g]quinolizine-2,9-diol (13as)-5, 8,13,13a-tetrahydro-3,10-dimethoxy-6H-dibenzo[a,g]quinolizine-2,9-diol (S)-scoulerine S-scoulerine
kegg.compound:C02106 keggC:C02106	(S)-Scoulerine (13aS)-5,8,13,13a-Tetrahydro-3,10-dimethoxy-6H-dibenzo[a,g]quinolizine-2,9-diol
sabiork.compound:6004 sabiorkM:6004	(S)-Scoulerine (13aS)-5,8,13,13a-tetrahydro-3,10-dimethoxy-6H- dibenzo[a,g]quinolizine-2,9-diol (13aS)-5,8,13,13a-tetrahydro-3,10-dimethoxy-6H-dibenzo[a,g]quinolizine-2,9-diol
metacyc.compound:S-SCOULERINE metacycM:S-SCOULERINE	(S)-scoulerine (-)-scoulerine (13aS)-3,10-dimethoxy-5,8,13,13a-tetrahydro-6H-isoquino[3,2-a]isoquinoline-2,9-diol (13aS)-5,8,13,13a-tetrahydro-3,10-dimethoxy-6H-dibenzo[a,g]quinolizine-2,9-diol
chebi:11071 chebi:12413 chebi:18801 chebi:442 keggC:M_C02106 seedM:M_cpd01427	secondary/obsolete/fantasy identifier