Hypoglycine A
PubChem CID: 11768666
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| Compound Synonyms | HYPOGLYCIN, 156-56-9, 2-Methylenecyclopropanealanine, Hypoglycin A, Hypoglycine A, (2S)-2-amino-3-[(1R)-2-methylidenecyclopropyl]propanoic acid, Cyclopropanealanine, 2-methylene-, (2S,4R)-Hypoglycin A, Cyclopropanealanine, 2-methylene, L-, NSC 303803, 2-Amino-4,5-methylenehex-5-enoic acid, 2-Methylenecyclopropanylalanine, HSDB 3496, beta-(Methylenecyclopropyl)alanine, 7GB7U7M282, HYPOGLYCIN [HSDB], HYPOGLYCINE A [MI], beta-(Methylenecyclopropyl)alanine (VAN), S-Hypoglycine A, 85per cent, alpha-Aminomethylenecyclopropanepropionic acid, DTXSID70878975, alpha-Amino-2-methylenecyclopropanepropanoic acid, alpha-Amino-2-methylenecyclopropanepropionic acid, HYPOGLYCIN A, (2S,4R)-, Cyclopropanepropanoic acid, alpha-amino-2-methylene-, L-alpha-Amino-beta-methylenecyclopropanepropionic acid, NSC-303803, alpha-Amino-beta-(2-methylenecyclopropyl)propionic acid, (S)-2-Amino-3-((R)-2-methylenecyclopropyl)propanoic acid, Cyclopropanepropionic acid, alpha-amino-2-methylene-, L-(+)-, S-Hypoglycine A, .ALPHA.-AMINO-2-METHYLENECYCLOPROPANEPROPANOIC ACID, Cyclopropanepropionic acid, .alpha.-amino-2-methylene-, L-(+)-, .beta.-(Methylenecyclopropyl)alanine, (.ALPHA.S,1R)-.ALPHA.-AMINO-2-METHYLENECYCLOPROPANEPROPANOIC ACID, Cyclopropanepropanoic acid, .alpha.-amino-2-methylene-, (.alpha.S,1R)-, CYCLOPROPANEPROPANOIC ACID, .ALPHA.-AMINO-2-METHYLENE-, (S-(R*,S*))-, .alpha.-Aminomethylenecyclopropanepropionic acid, (S)-Hypoglycine A, 85%, .alpha.-Amino-2-methylenecyclopropanepropionic acid, Cyclopropanepropanoic acid, .alpha.-amino-2-methylene-, L-.alpha.-Amino-.beta.-methylenecyclopropanepropionic acid, CHEBI:134622, .alpha.-Amino-.beta.-(2-methylenecyclopropyl)propionic acid, (2S)-2-amino-3-((1R)-2-methylidenecyclopropyl)propanoic acid, (2S)-2-azaniumyl-3-((1R)-2-methylidenecyclopropyl)propanoate, (2S)-2-azaniumyl-3-[(1R)-2-methylidenecyclopropyl]propanoate, UNII-7GB7U7M282, Hypoglycin-A, L-beta-(methylenecyclopropyl)-alanine, 2Methylenecyclopropanealanine, 2Methylenecyclopropanylalanine, SCHEMBL476273, Cyclopropanealanine, 2methylene, beta(Methylenecyclopropyl)alanine, CHEMBL1615355, 2-amino-3-(2-methylidenecyclopropyl)propanoic acid, 2Amino4,5methylenehex5enoic acid, CHEBI:195718, DTXCID301016998, Cyclopropanealanine, 2methylene, L, (alpha S,1R)-alpha-Amino-2-methylenecyclopropanepropanoic acid, AKOS006341731, beta(Methylenecyclopropyl)alanine (VAN), FH176074, alphaAminomethylenecyclopropanepropionic acid, alphaAmino2methylenecyclopropanepropanoic acid, alphaAmino2methylenecyclopropanepropionic acid, CS-0231163, Cyclopropanepropanoic acid, alphaamino2methylene, EN300-1072865, LalphaAminobetamethylenecyclopropanepropionic acid, 2-azaniumyl-3-(2-methylidenecyclopropyl)propanoate, alphaAminobeta(2methylenecyclopropyl)propionic acid, Q418173, Cyclopropanepropionic acid, alphaamino2methylene, L(+), (S)-2-Amino-3-((R)-2-methylenecyclopropyl)propanoicacid, Cyclopropanepropanoic acid, alpha-amino-2-methylene-(9CI), (ALPHAS,1R)-ALPHA-AMINO-2-METHYLENECYCLOPROPANEPROPANOIC ACID, CYCLOPROPANEPROPANOIC ACID, ALPHA-AMINO-2-METHYLENE-, (ALPHAS,1R)-, CYCLOPROPANEPROPANOIC ACID, ALPHA-AMINO-2-METHYLENE-, (S-(R*,S*))- |
|---|---|
| Ghose Rule | False |
| Classyfire Kingdom | Organic compounds |
| Topological Polar Surface Area | 63.3 |
| Hydrogen Bond Donor Count | 2.0 |
| Pfizer 3 75 Rule | False |
| Scaffold Graph Level | CC1CC1 |
| Np Classifier Class | Aminoacids |
| Deep Smiles | N[C@H]C=O)O))C[C@H]CC3=C |
| Heavy Atom Count | 10.0 |
| Classyfire Class | Carboxylic acids and derivatives |
| Scaffold Graph Node Level | CC1CC1 |
| Classyfire Subclass | Amino acids, peptides, and analogues |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 176.0 |
| Database Name | imppat_phytochem;pubchem |
| Defined Atom Stereocenter Count | 2.0 |
| Iupac Name | (2S)-2-amino-3-[(1R)-2-methylidenecyclopropyl]propanoic acid |
| Veber Rule | True |
| Classyfire Superclass | Organic acids and derivatives |
| Xlogp | -2.5 |
| Gsk 4 400 Rule | True |
| Molecular Formula | C7H11NO2 |
| Scaffold Graph Node Bond Level | C=C1CC1 |
| Inchi Key | OOJZCXFXPZGUBJ-RITPCOANSA-N |
| Silicos It Class | Soluble |
| Rotatable Bond Count | 3.0 |
| Synonyms | hypoglycin, hypoglycin a |
| Esol Class | Highly soluble |
| Functional Groups | C=C1CC1, CC(=O)O, CN |
| Compound Name | Hypoglycine A |
| Exact Mass | 141.079 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 141.079 |
| Hydrogen Bond Acceptor Count | 3.0 |
| Molecular Weight | 141.17 |
| Gi Absorption | True |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 2.0 |
| Total Bond Stereocenter Count | 0.0 |
| Lipinski Rule Of 5 | True |
| Inchi | InChI=1S/C7H11NO2/c1-4-2-5(4)3-6(8)7(9)10/h5-6H,1-3,8H2,(H,9,10)/t5-,6+/m1/s1 |
| Smiles | C=C1C[C@@H]1C[C@@H](C(=O)O)N |
| Np Classifier Biosynthetic Pathway | Amino acids and Peptides |
| Defined Bond Stereocenter Count | 0.0 |
| Egan Rule | True |
| Np Classifier Superclass | Small peptides |
- 1. Outgoing r'ship
FOUND_INto/from Blighia Sapida (Plant) Rel Props:Reference:https://doi.org/10.15482/usda.adc/1239279 - 2. Outgoing r'ship
FOUND_INto/from Dimocarpus Longan (Plant) Rel Props:Reference:ISBN:9780387706375; ISBN:9788172362300