| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 8th, 2004 | 8 | Yes |
Popular Name: D-Threonine D-Threonine
Find On: PubMed — Wikipedia — Google
CAS Numbers: 144-98-9 , 24830-94-2 , 28954-12-3 , 632-20-2 , 7004-04-8 , 72-19-5 , 80-68-2 , [80-68-2]
(+/-)-2-Amino-3-hydroxybutyric acid
(2R,3S)-2-amino-3-hydroxybutanoate; D-threonine anion
(2R,3S)-2-Amino-3-hydroxybutanoic acid
(2R,3S)-2-amino-3-hydroxybutanoic acid; D-2-Amino-3-hydroxybutyric acid; D-THREONINE; D-Threonin
(2R,3S)-2-Amino-3-hydroxybutyric acid
(2S,3R)-2-Amino-3-hydroxybutanoic acid
(R)-Threonine; BRN 1721643; D-Threonine; EINECS 211-171-8; LS-153744; NSC 46702; Threonine, D-
2-amino-3-hydroxybutanoic acid
2-amino-3-hydroxybutyric acid; 632-20-2; D-thr; D-threonine
632-20-2; C00820; D-2-Amino-3-hydroxybutyric acid; D-Threonine
D-Threonine [632-20-2]; (H-D-Thr-OH)
D-THREONINE, allo free; [632-20-2]
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | -3.30 | -2.12 | -39.11 | 4 | 4 | 0 | 88 | 119.12 | 2 | ↓ |
| Hi High (pH 8-9.5) | -3.30 | -2.45 | -48.07 | 3 | 4 | -1 | 86 | 118.112 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Mp [°C] | 274 | Acros Organics |
| MP | 274 °C | Indofine |
| MP | 28 - 30 | Enamine Building Blocks |
| MP | 28...30 | Enamine Building Blocks |
| UniProt Database Links | 4FTAS_STRCT; AK1H_ECOLI; AK1H_SERMA; AK1_ARATH; AK1_BACSU; AK2H_ECOLI; AK2_ARATH; AK2_BACSU; AK3_ARATH; AK3_BACSU; AKH1_ARATH; AKH1_MAIZE; AKH2_ARATH; AKH2_MAIZE; AKH_BUCAI; AKH_BUCAP; AKH_BUCBP; AKH_DAUCA; AKH_HAEIN; AK_AQUAE; AK_BACSG; AK_CHLMU; AK_CHLP | ChEBI |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 98% | APIChem |
| Melting_Point | ca 244? dec. | Alfa-Aesar |
| Melting_Point | ca 244° dec. | Alfa-Aesar |
| Melting_Point | ca 274? dec. | Alfa-Aesar |
| Melting_Point | ca 274° dec. | Alfa-Aesar |
| UniProt Database Links | CI1BD_CONRA; DAPDH_URETH; DHAA_PARDE; DSD1_YEAST; DTA_ARTSP; YDFG_ECOLI | ChEBI |
| Patent Database Links | EP0898963; EP0922699; EP0933365; EP0951842; EP0971025; EP1106609; EP1113008; EP1123929; EP1219634; EP1323419; EP1323420; EP1348759; EP1364941; EP1422218; EP1505062; EP1512413; EP1536000; EP1550720; EP1552826; EP1557173; EP1566180; EP1566181; EP1574578; EP | ChEBI |
| Patent Database Links | EP1422218; EP1586583; EP1657249; EP1698638; US2002052322; US2004034080; US7256172 | ChEBI |
| S phrase | S24/25: Avoid contact with skin and eyes. | Acros Organics |
| Notes | USP, pyrogen free | Apollo Scientific Bioactives |
