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Details

Stereochemistry ABSOLUTE
Molecular Formula C10H13NO7S
Molecular Weight 291.278
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-O-METHYLDOPA-4-SULFATE

SMILES

COC1=C(OS(O)(=O)=O)C=CC(C[C@H](N)C(O)=O)=C1

InChI

InChIKey=OOMSDJKDKVRCSI-ZETCQYMHSA-N
InChI=1S/C10H13NO7S/c1-17-9-5-6(4-7(11)10(12)13)2-3-8(9)18-19(14,15)16/h2-3,5,7H,4,11H2,1H3,(H,12,13)(H,14,15,16)/t7-/m0/s1

HIDE SMILES / InChI

Molecular Formula C10H13NO7S
Molecular Weight 291.278
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 22:27:40 GMT 2025
Edited
by admin
on Mon Mar 31 22:27:40 GMT 2025
Record UNII
9L0Z6V86DL
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-O-METHYLDOPA-4-SULFATE
Common Name English
3-O-METHYL-L-DOPA-4-SULFATE
Preferred Name English
L-TYROSINE, 3-METHOXY-O-SULFO-
Systematic Name English
Code System Code Type Description
PUBCHEM
91800073
Created by admin on Mon Mar 31 22:27:40 GMT 2025 , Edited by admin on Mon Mar 31 22:27:40 GMT 2025
PRIMARY
CAS
1391393-86-4
Created by admin on Mon Mar 31 22:27:40 GMT 2025 , Edited by admin on Mon Mar 31 22:27:40 GMT 2025
PRIMARY
FDA UNII
9L0Z6V86DL
Created by admin on Mon Mar 31 22:27:40 GMT 2025 , Edited by admin on Mon Mar 31 22:27:40 GMT 2025
PRIMARY