3-Amino-4-Methylpentanoic Acid 3-氨基-4-甲基戊酸

CAS 5699-54-7 MFCD00800505

化学结构图

5699-54-7
SMILES: CC(C)C(N)CC(=O)O

化学属性

Mol. FormulaC6H13NO2
Mol. Weight131.18
Melting Point206-209°C
Density1.035
Boiling Point232°C at 760 mmHg

别名和识别编码

Chemical Name3-Amino-4-Methylpentanoic Acid
CAS Number5699-54-7
Alfabeta NameAMINOMETHYLPENTANOICACID 34---
MDL NumberMFCD00800505
Synonym 3-Amino-4-methylpentanoic acid {LY} 3-Amino-4-methylpentanoic acid {} {LY} 3-Amino-4-methylpentanoic acid {} {} {LY} 3-Amino-4-methylpentanoic acid {} {} {} {LY} 3-Amino-4-methylpentanoic acid {} {} {} {} {LY} 3-Amino-4-methylpentanoic acid {} {} {} {} {} {LY} 3-Amino-4-methylpentanoic acid {} {} {} {} {} {} {LY} 3-Amino-4-methylpentanoic acid {} {} {} {} {} {} {} {LY} 3-Amino-4-methylpentanoic acid {} {} {} {} {} {} {} {} {LY} 3-Amino-4-methylpentanoic acid {} {} {} {} {} {} {} {} {} {LY} 3-Amino-4-methylpentanoic acid {} {} {} {} {} {} {} {} {} {} {LY} 3-Amino-4-methylpentanoic acid {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Amino-4-methylpentanoic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Amino-4-methylpentanoic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Amino-4-methylpentanoic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Amino-4-methylpentanoic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Am
PubChem Substance ID193411
Beilstein Registry Number1747371
Chemical Name Translation3-氨基-4-甲基戊酸
InChIKeyGLUJNGJDHCTUJY-UHFFFAOYSA-N
LabNetwork Molecule IDLN00141199
InChIInChI=1S/C6H13NO2/c1-4(2)5(7)3-6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9)
Canonical SMILESCC(C)C(N)CC(O)=O
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分类

  • {SNA} Beta-Amino Acids, Chemical Biology, Chemical Synthesis, Peptide Chemistry, Unnatural Amino Acids & Derivatives
  • {KO} beta-Amino Acids
  • {KO} CarboxylicAcids
  • {SNA} Beta-Amino Acids, Chemical Biology, Chemical Synthesis, Peptide Chemistry, Unnatural Amino Acid Derivatives
  • {KO} AminesPrimary

安全信息

Warnings IRRITANT
WGK Germany3
Personal Protective Equipment Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter
Storage condition 2-8°C {LY} 2-8°C {} {LY} 2-8°C {} {} {LY} 2-8°C {} {} {} {LY} 2-8°C {} {} {} {} {LY} 2-8°C {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}

药物吸收、分布、代谢与排泄(ADME)

Lipinski's Rule of 3
Y
Lipinski's Rule of 5
Y
H-bond Donors
2
H-bond Acceptors
3
Rotatable Bonds
3
LogP
3.948000000000000e-001

系列性分类

  1. Chemical Synthesis 化学合成
  2. Chemical Biology 生物化学
  3. Peptide Chemistry 多肽化学
  4. Unnatural Amino Acid Derivatives 人工合成氨基酸
  5. Beta-Amino Acids - Unnatural Amino Acid Derivatives
  1. Chemical Synthesis 化学合成
  2. Chemical Biology 生物化学
  3. Peptide Chemistry 多肽化学
  4. Unnatural Amino Acid Derivatives 人工合成氨基酸
  5. Beta-Amino Acids - Unnatural Amino Acid Derivatives
  1. Medical Research Areas
  2. Metabolism
  3. Endogenous Metabolite  (内源性代谢物)

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