(R)-3-aminobutanoic acid
PubChem CID: 5706670
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| Compound Synonyms | (R)-3-Aminobutanoic Acid, 3775-73-3, (3R)-3-aminobutanoic acid, (R)-3-AMINOBUTYRIC ACID, (R)-HOMO-BETA-ALANINE, R-3-Aminobutyric acid, MFCD00211284, Butanoic acid, 3-amino-, (3R)-, (R)-3-AminobutanoicAcid, (R)-3-Amino-butyric acid, D-A-Homoalanine, (-)-3-Aminobutyric acid, 3-(R)-amino-butyric acid, (R)-beta-aminobutanoic acid, SCHEMBL598845, DTXSID10420710, OQEBBZSWEGYTPG-GSVOUGTGSA-N, BBL102269, STL556068, AKOS005146085, AKOS015995185, CS-W005235, GS-4128, FA139847, DB-027181, A3308, EN300-60248, 868-214-4 |
|---|---|
| Topological Polar Surface Area | 63.3 |
| Hydrogen Bond Donor Count | 2.0 |
| Heavy Atom Count | 7.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 72.1 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 1.0 |
| Iupac Name | (3R)-3-aminobutanoic acid |
| Prediction Hob | 1.0 |
| Xlogp | -3.1 |
| Molecular Formula | C4H9NO2 |
| Prediction Swissadme | 0.0 |
| Inchi Key | OQEBBZSWEGYTPG-GSVOUGTGSA-N |
| Fcsp3 | 0.75 |
| Logs | 0.801 |
| Rotatable Bond Count | 2.0 |
| Logd | -0.678 |
| Compound Name | (R)-3-aminobutanoic acid |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 103.063 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 103.063 |
| Hydrogen Bond Acceptor Count | 3.0 |
| Molecular Weight | 103.12 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 1.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | 1.5804498000000002 |
| Inchi | InChI=1S/C4H9NO2/c1-3(5)2-4(6)7/h3H,2,5H2,1H3,(H,6,7)/t3-/m1/s1 |
| Smiles | C[C@H](CC(=O)O)N |
| Nring | 0.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Geranium Pratense (Plant) Rel Props:Source_db:cmaup_ingredients - 2. Outgoing r'ship
FOUND_INto/from Pinellia Ternata (Plant) Rel Props:Source_db:cmaup_ingredients