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alpha-((Aminocarbonyl)amino)-4-hydroxybenzeneacetic acid

HCID 578941
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Basic information

CAS
32507-69-0
Standard SMILES
NC(=O)NC(C(=O)O)c1ccc(O)cc1
InChIKey
GSHIDXLOTQDUAV-UHFFFAOYSA-N
Molecular formula
C9H10N2O4
Average molar mass
210.19 g/mol
Monoisotopic mass
210.0640568

Overview

N-Carbamoyl-2-amino-2-(4-hydroxyphenyl)acetic acid is a N-carbamoyl-amino acid.

Names & identifiers

Preferred name
alpha-((Aminocarbonyl)amino)-4-hydroxybenzeneacetic acid
IUPAC
2-(carbamoylamino)-2-(4-hydroxyphenyl)acetic acid

Names & synonyms

72500-37-9alpha-((Aminocarbonyl)amino)-4-hydroxybenzeneacetic acidRefChem:10764002-(carbamoylamino)-2-(4-hydroxyphenyl)acetic acidBenzeneacetic acid, alpha-((aminocarbonyl)amino)-4-hydroxy-2-(4-Hydroxyphenyl)-2-ureidoacetic acidN-Carbamoyl-2-amino-2-(4-hydroxyphenyl)acetic acidN-Carbamoyl-2-(4-hydroxyphenyl)glycinep-hydroxyphenylhydantoic acidSCHEMBL9192957DTXSID70993334CHEBI:186002
Show more names
N-carbamoyl-2-(p-hydroxyphenyl)glycineEN300-1688981Glycine, N-carbamoyl-2-(p-hydroxyphenyl)-, DL-[(Aminocarbonyl)amino](4-hydroxyphenyl)acetic acid #alpha-(aminocarbonyl)amino-4-hydroxybenzeneacetic acid{[Hydroxy(imino)methyl]amino}(4-hydroxyphenyl)acetic acidBenzeneacetic acid, .alpha.-[(aminocarbonyl)amino]-4-hydroxy-, (.+/-.)-

Database identifiers

CAS
32507-69-0、72500-37-9
PubChem CID
578941
DTXSID
DTXSID70993334
ChEBI
CHEBI:186002
Nikkaji
J27.598K

Properties

Computed structural properties

XLogP
-0.1
Topological polar surface area
113 Ų
Hydrogen bond donors
4
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
15
Formal charge
0
Complexity
248

Chemistry & industry

Pharmacology

Cellular LocationsCytoplasm

Related reactions

8 records
New reaction record
HRID 225310 reaction equation
HRID 225310As productuspto-grants-1980_11
HRID 288466 reaction equation
HRID 288466As productTraining data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID 839254 reaction equation
HRID 839254As reactantuspto-grants-1978_06
HRID 892946 reaction equation
HRID 892946As productuspto-grants-1992_06
HRID 903824 reaction equation
HRID 903824As productuspto-grants-1980_10
HRID 1389405 reaction equation
HRID 1389405As productuspto-grants-1981_01
HRID 1565361 reaction equation
HRID 1565361As productTraining data from https://doi.org/10.1039/C8SC04228D (1/10)
HRID 2049213 reaction equation
HRID 2049213As productuspto-grants-1980_04

Compound notes

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