(R)-2-Amino-4-(aminooxy)butanoic acid
PubChem CID: 10176161
Connections displayed (default: 10).
Loading graph...
| Compound Synonyms | 128395-79-9, D-CANALINE, (R)-2-Amino-4-(aminooxy)butanoic acid, o-Amino-D-homoserine, D-Homoserine, O-amino-, Canaline, D-, (2R)-2-amino-4-aminooxybutanoic acid, 3TJQ8CI58K, (2R)-2-amino-4-(aminooxy)butanoic acid, (S)-2-Amino-4-(aminooxy)butanoic acid, UNII-3TJQ8CI58K, SCHEMBL440858, DTXSID80436383, (R)-2-Amino-4-(aminooxy)butanoicacid, EN300-7063695 |
|---|---|
| Topological Polar Surface Area | 98.6 |
| Hydrogen Bond Donor Count | 3.0 |
| Heavy Atom Count | 9.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 95.8 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 1.0 |
| Iupac Name | (2R)-2-amino-4-aminooxybutanoic acid |
| Prediction Hob | 1.0 |
| Xlogp | -4.6 |
| Molecular Formula | C4H10N2O3 |
| Prediction Swissadme | 0.0 |
| Inchi Key | FQPGMQABJNQLLF-GSVOUGTGSA-N |
| Fcsp3 | 0.75 |
| Logs | -0.107 |
| Rotatable Bond Count | 4.0 |
| Logd | -1.65 |
| Compound Name | (R)-2-Amino-4-(aminooxy)butanoic acid |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 134.069 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 134.069 |
| Hydrogen Bond Acceptor Count | 5.0 |
| Molecular Weight | 134.13 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 1.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | 2.484063 |
| Inchi | InChI=1S/C4H10N2O3/c5-3(4(7)8)1-2-9-6/h3H,1-2,5-6H2,(H,7,8)/t3-/m1/s1 |
| Smiles | C(CON)[C@H](C(=O)O)N |
| Nring | 0.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Canavalia Gladiata (Plant) Rel Props:Source_db:cmaup_ingredients - 2. Outgoing r'ship
FOUND_INto/from Corydalis Cava (Plant) Rel Props:Source_db:cmaup_ingredients - 3. Outgoing r'ship
FOUND_INto/from Corydalis Cheilanthifolia (Plant) Rel Props:Source_db:cmaup_ingredients - 4. Outgoing r'ship
FOUND_INto/from Corydalis Rotundatour (Plant) Rel Props:Source_db:cmaup_ingredients - 5. Outgoing r'ship
FOUND_INto/from Corydalis Yanhusuo (Plant) Rel Props:Source_db:cmaup_ingredients - 6. Outgoing r'ship
FOUND_INto/from Lotus Corniculatus (Plant) Rel Props:Source_db:cmaup_ingredients - 7. Outgoing r'ship
FOUND_INto/from Medicago Sativa (Plant) Rel Props:Source_db:cmaup_ingredients - 8. Outgoing r'ship
FOUND_INto/from Robinia Pseudoacacia (Plant) Rel Props:Source_db:cmaup_ingredients - 9. Outgoing r'ship
FOUND_INto/from Zanthoxylum Brachyacanthum (Plant) Rel Props:Source_db:cmaup_ingredients - 10. Outgoing r'ship
FOUND_INto/from Zanthoxylum Veneficium (Plant) Rel Props:Source_db:cmaup_ingredients