| Common Name |
Hypoglycin B
| Description |
Hypoglycin B is found in fruits. Hypoglycin B is a biologically active component of Blighia sapida (akee apple) Hypoglycin B is a naturally occurring organic compound in the species Blighia sapida. It is particliarly concentrated in the fruit of the plant especially in the seeds. Hypoglycin B is toxic if ingested and is a causative agent of Jamaican Vomiting Sickness. It is an amino acid and chemically related to lysine.Hypoglycin b belongs to the family of N-acyl-alpha Amino Acids and Derivatives. These are compounds containing an alpha amino acid which bears an acyl group at his terminal nitrogen atom.
| Structure |
MOLSDFPDBSMILESInChI
Structure for HMDB29428 (Hypoglycin B)
| Synonyms |
| Value |
Source |
Hypoglycine bHMDB
L-gamma-Glutamyl-L-hypoglycinHMDB
N-g-Glutamyl-3-(methylenecyclopropyl)alanine, 9ciHMDB
| Chemical Formlia |
C12H18N2O5
| Average Molecliar Weight |
270.2817
| Monoisotopic Molecliar Weight |
270.121571696
| IUPAC Name |
2-amino-4-{[1-carboxy-2-(2-methylidenecyclopropyl)ethyl]carbamoyl}butanoic acid
| Traditional Name |
2-amino-4-{[1-carboxy-2-(2-methylidenecyclopropyl)ethyl]carbamoyl}butanoic acid
| CAS Registry Number |
502-37-4
| SMILES |
NC(CCC(=O)NC(CC1CC1=C)C(O)=O)C(O)=O
| InChI Identifier |
InChI=1S/C12H18N2O5/c1-6-4-7(6)5-9(12(18)19)14-10(15)3-2-8(13)11(16)17/h7-9H,1-5,13H2,(H,14,15)(H,16,17)(H,18,19)
| InChI Key |
UYDZYCPIQSRXKU-UHFFFAOYSA-N
| Chemical Taxonomy |
| Classification |
Not classified
| Ontology |
| Status |
Expected but not Quantified
| Origin |
Endogenous
Food
| Biofunction |
Not Available
| Application |
Nutrient
| Cellliar locations |
Cytoplasm
Extracellliar
| Physical Properties |
| State |
Not Available
| Experimental Properties |
| Property |
Value |
Reference |
Melting Point200 – 207 °CNot Available
Boiling PointNot AvailableNot Available
Water SolubilityNot AvailableNot Available
LogPNot AvailableNot Available
| Predicted Properties |
| Property |
Value |
Source |
Water Solubility12.1 mg/mLALOGPS
logP-2.7ALOGPS
logP-3.1ChemAxon
logS-1.4ALOGPS
pKa (Strongest Acidic)1.82ChemAxon
pKa (Strongest Basic)9.31ChemAxon
Physiological Charge-1ChemAxon
Hydrogen Acceptor Count6ChemAxon
Hydrogen Donor Count4ChemAxon
Polar Surface Area129.72 Å2ChemAxon
Rotatable Bond Count8ChemAxon
Refractivity64.78 m3·mol-1ChemAxon
Polarizability26.96 Å3ChemAxon
Number of Rings1ChemAxon
Bioavailability1ChemAxon
Rlie of FiveYesChemAxon
Ghose FilterYesChemAxon
Vebers RlieYesChemAxon
MDDR-like RlieYesChemAxon
| Spectra |
| Spectra |
Not Available
| Biological Properties |
| Cellliar Locations |
Cytoplasm
Extracellliar
| Biofluid Locations |
Not Available
| Tissue Location |
Not Available
| Pathways |
Not Available
| Normal Concentrations |
| Not Available |
| Abnormal Concentrations |
|
Not Available
| Associated Disorders and Diseases |
| Disease References |
None
| Associated OMIM IDs |
None
| External Links |
| DrugBank ID |
Not Available
| DrugBank Metabolite ID |
Not Available
| Phenol Explorer Compound ID |
Not Available
| Phenol Explorer Metabolite ID |
Not Available
| FoodDB ID |
FDB000530
| KNApSAcK ID |
C00001360
| Chemspider ID |
97200
| KEGG Compound ID |
C08280
| BioCyc ID |
Not Available
| BiGG ID |
Not Available
| Wikipedia Link |
Hypoglycin_B
| NuGOwiki Link |
HMDB29428
| Metagene Link |
HMDB29428
| METLIN ID |
Not Available
| PubChem Compound |
108105
| PDB ID |
Not Available
| ChEBI ID |
Not Available
Product: Lixisenatide
References |
| Synthesis Reference |
Not Available |
| Material Safety Data Sheet (MSDS) |
Not Available |
| General References |
- (). Yannai, Shmuel. (2004) Dictionary of food compounds with CD-ROM: Additives, flavors, and ingredients. Boca Raton: Chapman & Hall/CRC.. .
|
PMID: 9283714
