Compound Summary


4-Aminohex-5-ynoic acid
  Compound Information
 4-Aminohex-5-ynoic acid

Compound Name:

4-Aminohex-5-ynoic acid

Compound CID:

3452

Synonyms:

4-Aminohex-5-ynoic acid

gamma-Acetylenic gaba

gamma-Acetylinic GABA

4-Amino-5-hexynoic acid

57659-38-8

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Iupac Name:

4-aminohex-5-ynoic acid

InChI:

InChI=1S/C6H9NO2/c1-2-5(7)3-4-6(8)9/h1,5H,3-4,7H2,(H,8,9)

InChIKey:

BJNIHWSOVCDBHS-UHFFFAOYSA-N

Canonical Smiles:

C#CC(CCC(=O)O)N

Isomeric Smiles:

C#CC(CCC(=O)O)N

Molecular Weight:

127.14

Molecular Formula:

C6H9NO2

  Compound Structure
 2D Structure:
 3D Structure:
  Computed Properties
 4-Aminohex-5-ynoic acid

Molecular Weight:

127.14

Molecular Formula:

C6H9NO2

Hydrogen Bond Donor Count:

2

Hydrogen Bond Acceptor Count:

3

Rotatable Bond Count:

3

Heavy Atom Count:

9

Complexity:

144

  Synonyms
 4-Aminohex-5-ynoic acid

4-Aminohex-5-ynoic acid 4-Aminohex-5-ynoic acid

4-Aminohex-5-ynoic acid

gamma-Acetylenic gaba

gamma-Acetylinic GABA

4-Amino-5-hexynoic acid

57659-38-8

gamma-acetylenic-gamma-aminobutyric acid

RMI 71645

5-Hexynoic acid, 4-amino-

RMI-71645

Acetylenic GABA-7

4-ami-nohex-5-ynoic acid

4-Amino-hex-5-ynoic acid

Lopac0_000138

SCHEMBL690785

CHEMBL330129

4-Amino-5-hexynoic acid, solid

BDBM81477

DTXSID40973249

HMS3260K18

Tox21_500138

PDSP1_000142

PDSP2_000141

AKOS006272245

CCG-204233

LP00138

SDCCGSBI-0050126.P002

NCGC00015019-02

NCGC00015019-03

NCGC00015019-04

NCGC00015019-05

NCGC00093628-01

NCGC00093628-02

NCGC00260823-01

CAS_57659-38-8

EU-0100138

SR-01000075598

SR-01000075598-1

Q27286546

  Experimental Data
 4-Aminohex-5-ynoic acid

Species Dose Unit Control(Avg days) Treatment(Avg days) Avg/Med Lifespan Change(%) Control(Max days) Treatment(Max days) Max Lifespan Change(%) Significant Strain Gender PubMed Avg/Med Lifespan Change tab
Caenorhabditis elegans 33.000000000000000 umol/L 4.000000000000000 NS N2 24134630 Inactive
  Experimental Data Visualization
 4-Aminohex-5-ynoic acid

  Statistics Data
 4-Aminohex-5-ynoic acid

Species Avg/Med Lifespan Change(%) Max Lifespan Change(%) Count Reference Count Data point
Caenorhabditis elegans 4.000000000000000 1 1
  Statistics Data Visualization
 4-Aminohex-5-ynoic acid