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(S)-reticuline

PropertiesImage
MNX_IDMNXM1059 Image of MNXM1059
referencechebi:57873
formulaC19H24NO4
global charge1
mol weight330.404
InChIKeyBHLYRWXGMIUIHG-HNNXBMFYSA-O
InChIInChI=1S/C19H23NO4/c1-20-7-6-13-10-19(24-3)17(22)11-14(13)15(20)8-12-4-5-18(23-2)16(21)9-12/h4-5,9-11,15,21-22H,6-8H2,1-3H3/p+1/t15-/m0/s1
SMILESCOC1=CC2=C(C=C1O)[C@H](CC1=CC(O)=C(OC)C=C1)[NH+](C)CC2
MNX internals
InChI (mnx)InChI=1/C19H23NO4/c1-20-7-6-13-10-19(24-3)17(22)11-14(13)15(20)8-12-4-5-18(23-2)16(21)9-12/h4-5,9-11,15,21-22H,6-8H2,1-3H3/t15-/m0/s1 Image of MNXM1059
SMILES (mnx)[CH3:1][N:20]1[CH2:7][CH2:6][C:13]2=[CH:10][C:19]([O:24][CH3:3])=[C:17]([OH:22])[CH:11]=[C:14]2[C@@H:15]1[CH2:8][C:12]1=[CH:9][C:16]([OH:21])=[C:18]([O:23][CH3:2])[CH:5]=[CH:4]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)23
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:57873
chebi:57873
BHLYRWXGMIUIHG-HNNXBMFYSA-O 		(S)-reticuline
(1S)-7-hydroxy-1-(3-hydroxy-4-methoxybenzyl)-6-methoxy-2-methyl-1,2,3,4-tetrahydroisoquinolinium
(S)-reticulinium cation
(S)-reticulinium(1+)

seed.compound:cpd01426
seedM:cpd01426
BHLYRWXGMIUIHG-HNNXBMFYSA-O 		(+)-Reticuline
(1S)-1-(3-hydroxy-4-methoxybenzyl)-6-methoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-7-ol
(S)-Reticuline
(S)-reticuline
1-[(3-hydroxy-4-methoxy-phenyl)methyl]-6-methoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-7-ol

sabiork.compound:7789
sabiorkM:7789
BHLYRWXGMIUIHG-HNNXBMFYSA-N 		(R)-Reticuline
(+)-Reticuline
(1R)-1,2,3,4-Tetrahydro-1-[(3-hydroxy-4-methoxyphenyl)methyl]-6- methoxy-2-methyl-7-isoquinolinol
(1R)-1,2,3,4-Tetrahydro-1-[(3-hydroxy-4-methoxyphenyl)methyl]-6-methoxy-2-methyl-7-isoquinolinol

sabiork.compound:6003
sabiorkM:6003
BHLYRWXGMIUIHG-HNNXBMFYSA-N 		(S)-Reticuline

kegg.compound:C02105
keggC:C02105
BHLYRWXGMIUIHG-HNNXBMFYSA-N 		(S)-Reticuline
(+)-Reticuline
hmdb:HMDB0003601
BHLYRWXGMIUIHG-HNNXBMFYSA-N 		(S)-Reticuline
(+)-Reticuline
(+,-)-reticuline
(1S)-1,2,3,4-Tetrahydro-1-[(3-hydroxy-4-methoxyphenyl)methyl]-6-methoxy-2-methyl-7-isoquinolinol
(1S)-1-[(3-hydroxy-4-methoxyphenyl)methyl]-6-methoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-7-ol
(S)-(+)-Reticuline
(S)-Reticulene
L-(+)-Reticuline
Reticline
Reticulin
Reticuline
S-(+)-Reticuline

CHEBI:16718
chebi:16718
BHLYRWXGMIUIHG-HNNXBMFYSA-N 		(S)-reticuline
(+)-Reticuline
(+)-reticuline
(1S)-1-(3-hydroxy-4-methoxybenzyl)-6-methoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-7-ol
(S)-(+)-reticuline
(S)-Reticuline
L-(+)-Reticuline
Reticline

metacyc.compound:S-RETICULINE
metacycM:S-RETICULINE
BHLYRWXGMIUIHG-HNNXBMFYSA-O 		(S)-reticuline
(1S)-1-(3-hydroxy-4-methoxybenzyl)-6-methoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-7-ol

hmdb:HMDB03601
chebi:11070
chebi:12412
chebi:18800
chebi:441
keggC:M_C02105
seedM:M_cpd01426 		secondary/obsolete/fantasy identifier