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Dopa methyl ester

PropertiesImage
MNX_IDMNXM167659 Image of MNXM167659
referencesabiorkM:26807
formulaC10H13NO4
global charge0
mol weight211.217
InChIKeyXBBDACCLCFWBSI-UHFFFAOYSA-N
InChIInChI=1S/C10H13NO4/c1-15-10(14)7(11)4-6-2-3-8(12)9(13)5-6/h2-3,5,7,12-13H,4,11H2,1H3
SMILESCOC(=O)C(N)CC1=CC(O)=C(O)C=C1
MNX internals
InChI (mnx)InChI=1/C10H13NO4/c1-15-10(14)7(11)4-6-2-3-8(12)9(13)5-6/h2-3,5,7,12-13H,4,11H2,1H3/t7? Image of MNXM167659
SMILES (mnx)[CH3:1][O:15][C:10]([CH:7]([CH2:4][C:6]1=[CH:5][C:9]([OH:13])=[C:8]([OH:12])[CH:3]=[CH:2]1)[NH2:11])=[O:14]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

sabiork.compound:26807
sabiorkM:26807
XBBDACCLCFWBSI-UHFFFAOYSA-N 		Dopa methyl ester
hmdb:HMDB0254424
XBBDACCLCFWBSI-UHFFFAOYSA-N 		Melevodopa
DL-Dopa methyl ester
Dopa methyl ester, (D)-isomer
L-Dopa methyl ester
Levodopa methyl ester
Levodopa methyl ester hydrochloride
Levodopa methyl ester hydrochloride, (DL)-isomer
Methyl L-dopa
methyl 2-amino-3-(3,4-dihydroxyphenyl)propanoate