(S)-2-Amino-4-hydroxybutanoic acid hydrochloride
PubChem CID: 44539543
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| Compound Synonyms | (S)-2-Amino-4-hydroxybutanoic acid hydrochloride, 123053-31-6, (S)-2-Amino-4-hydroxybutanoic acid, HCl, L-3-Homoserine Hydrochloride, (2S)-2-amino-4-hydroxybutanoic acid hydrochloride, 672-15-1 (non-salt), DTXSID00659274, AKOS015892796, L-Homoserine--hydrogen chloride (1/1) |
|---|---|
| Topological Polar Surface Area | 83.6 |
| Hydrogen Bond Donor Count | 4.0 |
| Heavy Atom Count | 9.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 83.4 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 1.0 |
| Iupac Name | (2S)-2-amino-4-hydroxybutanoic acid, hydrochloride |
| Prediction Hob | 1.0 |
| Molecular Formula | C4H10ClNO3 |
| Prediction Swissadme | 0.0 |
| Inchi Key | ANRLEQNQSYGXBB-DFWYDOINSA-N |
| Fcsp3 | 0.75 |
| Logs | -0.175 |
| Rotatable Bond Count | 3.0 |
| Logd | 0.908 |
| Compound Name | (S)-2-Amino-4-hydroxybutanoic acid hydrochloride |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 155.035 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 155.035 |
| Hydrogen Bond Acceptor Count | 4.0 |
| Molecular Weight | 155.58 |
| Covalent Unit Count | 2.0 |
| Total Atom Stereocenter Count | 1.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | 1.6487977999999999 |
| Inchi | InChI=1S/C4H9NO3.ClH/c5-3(1-2-6)4(7)8, /h3,6H,1-2,5H2,(H,7,8), 1H/t3-, /m0./s1 |
| Smiles | C(CO)[C@@H](C(=O)O)N.Cl |
| Nring | 5.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Astragalus Sinicus (Plant) Rel Props:Source_db:cmaup_ingredients - 2. Outgoing r'ship
FOUND_INto/from Canavalia Gladiata (Plant) Rel Props:Source_db:cmaup_ingredients - 3. Outgoing r'ship
FOUND_INto/from Eucalyptus Globulus (Plant) Rel Props:Source_db:cmaup_ingredients - 4. Outgoing r'ship
FOUND_INto/from Pisum Sativum (Plant) Rel Props:Source_db:cmaup_ingredients - 5. Outgoing r'ship
FOUND_INto/from Polygonatum Cyrtonema (Plant) Rel Props:Source_db:cmaup_ingredients - 6. Outgoing r'ship
FOUND_INto/from Pterocarpus Indicus (Plant) Rel Props:Source_db:cmaup_ingredients - 7. Outgoing r'ship
FOUND_INto/from Salvia Trijuga (Plant) Rel Props:Source_db:cmaup_ingredients