(1R,2R)-2-amino-1-(4-aminophenyl)propane-1,3-diol(1+) (CHEBI:143073)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	(1R,2R)-2-amino-1-(4-aminophenyl)propane-1,3-diol(1+)

ChEBI ID	CHEBI:143073

ChEBI ASCII Name	(1R,2R)-2-amino-1-(4-aminophenyl)propane-1,3-diol(1+)

Definition	Major species at pH 7.3.

Stars	This entity has been manually annotated by a third party.

Submitter	Anne Morgat

Supplier Information

Download	Molfile XML SDF

Formula

C9H15N2O2

Net Charge

Average Mass

183.228

Monoisotopic Mass

183.11280

InChI

InChI=1S/C9H14N2O2/c10-7-3-1-6(2-4-7)9(13)8(11)5-12/h1-4,8-9,12-13H,5,10-11H2/p+1/t8-,9-/m1/s1

InChIKey

HOSHJSFGXZIFCZ-RKDXNWHRSA-O

SMILES

C1=CC(=CC=C1[C@H]([C@@H](CO)[NH3+])O)N

Roles Classification
Chemical Role(s):	Bronsted base A molecular entity capable of accepting a hydron from a donor (Bronsted acid). (via organic amino compound )

ChEBI Ontology
Outgoing	(1R,2R)-2-amino-1-(4-aminophenyl)propane-1,3-diol(1+) (CHEBI:143073) is a substituted aniline (CHEBI:48975)

Synonym	Source
(1R,2R)-2-amino-1-(4-aminophenyl)propane-1,3-diol	UniProt

Citation	Type	Source
25267678	PubMed citation	SUBMITTER