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salutaridinol

MNXM2301 is deprecated and here replaced by MNXM732799
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM732799 Image of MNXM732799
referencemetacycM:SALUTARIDINOL
formulaC19H24NO4
global charge1
mol weight330.404
InChIKeyLLSADFZHWMEBHH-QWYDSHIESA-O
InChIInChI=1S/C19H23NO4/c1-20-7-6-19-10-16(24-3)14(21)9-12(19)13(20)8-11-4-5-15(23-2)18(22)17(11)19/h4-5,9-10,13-14,21-22H,6-8H2,1-3H3/p+1/t13-,14?,19+/m1/s1
SMILESCOC1=CC=C2C[C@@H]3C4=C[C@H](O)C(OC)=C[C@]4(CC[NH+]3C)C2=C1O
MNX internals
InChI (mnx)InChI=1/C19H23NO4/c1-20-7-6-19-10-16(24-3)14(21)9-12(19)13(20)8-11-4-5-15(23-2)18(22)17(11)19/h4-5,9-10,13-14,21-22H,6-8H2,1-3H3/t13-,14?,19+/m1/s1 Image of MNXM732799
SMILES (mnx)[CH3:1][N:20]1[CH2:7][CH2:6][C@:19]23[CH:10]=[C:16]([O:24][CH3:3])[CH:14]([OH:21])[CH:9]=[C:12]2[C@H:13]1[CH2:8][C:11]1=[C:17]3[C:18]([OH:22])=[C:15]([O:23][CH3:2])[CH:5]=[CH:4]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)3
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

metacyc.compound:SALUTARIDINOL
metacycM:SALUTARIDINOL
LLSADFZHWMEBHH-QWYDSHIESA-O 		salutaridinol
5,6,8,14-tetradehydro-3,6-dimethoxy-17-methyl-morphinan-4,7-diol

CHEBI:38103
chebi:38103
LLSADFZHWMEBHH-VFPJAPOESA-N 		(7R)-salutaridinol
3,6-dimethoxy-17-methyl-5,6,8,14-tetradehydromorphinan-4,7beta-diol
7-epi-salutaridinol
salutaridinol-I

CHEBI:58463
chebi:58463
LLSADFZHWMEBHH-VFPJAPOESA-O 		(7S)-salutaridinol
(7S)-salutaridinol cation
(7S)-salutaridinol(1+)
3,6-dimethoxy-17-methyl-5,6,8,14-tetradehydromorphinan-17-ium-4,7alpha-diol

CHEBI:18373
chebi:18373
LLSADFZHWMEBHH-VFPJAPOESA-N 		(7S)-salutaridinol
3,6-dimethoxy-17-methyl-5,6,8,14-tetradehydromorphinan-4,7alpha-diol
5,6,8,14-Tetradehydro-3,6-dimethoxy-17-methyl-morphinan-4,7-diol
Salutaridinol
salutaridinol-II

kegg.compound:C05220
keggC:C05220
LLSADFZHWMEBHH-VFPJAPOESA-N 		Salutaridinol
5,6,8,14-Tetradehydro-3,6-dimethoxy-17-methyl-morphinan-4,7-diol

seed.compound:cpd03100
seedM:cpd03100
LLSADFZHWMEBHH-TYILLQQXSA-O 		Salutaridinol
5,6,8,14-Tetradehydro-3,6-dimethoxy-17-methyl-morphinan-4,7-diol
5,6,8,14-tetradehydro-3,6-dimethoxy-17-methyl-morphinan-4,7-diol
salutaridinol

CHEBI:26600
chebi:26600
LLSADFZHWMEBHH-VFPJAPOESA-N 		salutaridinol
3,6-dimethoxy-17-methyl-5,6,8,14-tetradehydromorphinan-4,7-diol

chebi:15063
chebi:1994
chebi:26599
keggC:M_C05220
seedM:M_cpd03100 		secondary/obsolete/fantasy identifier