L-Homoserine

HCID 12647CAS 498-19-1

基本情報

標準SMILES: N[C@@H](CCO)C(=O)O
InChIKey: UKAUYVFTDYCKQA-VKHMYHEASA-N
分子式: C4H9NO3
平均分子量: 119.12 g/mol
単同位体質量: 119.05824315

概要

L-homoserine is the L-enantiomer of homoserine. It has a role as a Saccharomyces cerevisiae metabolite, an Escherichia coli metabolite, a human metabolite and an algal metabolite. It is an enantiomer of a D-homoserine. It is a tautomer of a L-homoserine zwitterion.

名称と識別子

優先名称: L-Homoserine
IUPAC: (2S)-2-amino-4-hydroxybutanoic acid

名称と別名

L-homoserine672-15-1homoserine(2S)-2-amino-4-hydroxybutanoic acid2-Amino-4-hydroxybutyric acid6KA95X0IVODTXSID5075159CHEBI:156992-amino-4-hydroxybutanoateNSC-206251(2S)-2-azaniumyl-4-hydroxybutanoateCHEBI:30653

名称をさらに表示

Homoserine L-L Isomer OF homoserineRefChem:924416DTXCID1036046211-590-6932-027-72-Amino-4-hydroxybutanoic acidh-hoser-oh

データベース識別子

CAS: 498-19-1、672-15-1
PubChem CID: 12647
DTXSID: DTXSID201365201
ChEMBL: CHEMBL11722
ChEBI: CHEBI:15699
UNII: 6KA95X0IVO
EC Number: 211-590-6、932-027-7
Nikkaji: J9.199E

物性

構造計算による物性

XLogP: -4.4
極性表面積: 83.6 Å²
水素結合供与体数: 3
水素結合受容体数: 4
回転可能結合数: 3
重原子数: 8
形式電荷: 0
複雑度: 83.4

実験および物理化学的性質

DrugsPharmaceuticals -> Listed in ZINC15

Solubility1000.0 mg/mL

Melting Point203 °C

Physical DescriptionSolid

Collision Cross Section126.1 Å² [M+H]+

安全と法規制

GHS分類

GHS Classification · 5 件

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Not Classified