Cas no 5753-30-0 (D-Aspartic acid,3-hydroxy-, (3S)-)
5753-30-0 structure
Product Name:D-Aspartic acid,3-hydroxy-, (3S)-
CAS No:5753-30-0
MF:C4H7NO5
MW:149.102081537247
CID:376261
PubChem ID:6603868
Update Time:2025-04-19
D-Aspartic acid,3-hydroxy-, (3S)- Chemical and Physical Properties
Names and Identifiers
-
- D-Aspartic acid,3-hydroxy-, (3S)-
- (2R,3S)-2-amino-3-hydroxybutanedioic acid
- (2R,3S)-2-amino-3-hydroxy-succinic acid
- (2S,3S)-2-amino-3-hydroxysuccimid acid
- 2-(S)-amino-3-(S)-hydroxysuccinic acid
- 2-azanyl-3-hydroxy-butanedioic acid
- L-threo-3-hydroxyaspartate
- CHEMBL568192
- NCGC00015504-01
- (2R,3S)-2-amino-3-hydroxysuccinic acid
- erythro-3-hydroxy-D-aspartic acid
- (3S)-3-hydroxy-D-aspartic acid
- Q27129490
- 5753-30-0
- D-erythro-3-hydroxyaspartic acid
- C19838
- BDBM50378533
- rel-(3S)-3-Hydroxy-D-aspartic acid
- CHEBI:60893
- Lopac-H-2775
- SCHEMBL5019049
- erythro-beta-hydroxy-D-aspartic acid
- (2R,3S)-2-amino-3-hydroxy-succinicacid
- 6532-76-9
-
- Inchi： 1S/C4H7NO5/c5-1(3(7)8)2(6)4(9)10/h1-2,6H,5H2,(H,7,8)(H,9,10)/t1-,2+/m1/s1
- InChI Key： YYLQUHNPNCGKJQ-NCGGTJAESA-N
- SMILES： O[C@H](C(=O)O)[C@H](C(=O)O)N
Computed Properties
- Exact Mass: 149.03241
- Monoisotopic Mass: 149.03242232g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 10
- Rotatable Bond Count: 3
- Complexity: 156
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 2
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -4.4
- Topological Polar Surface Area: 121?2
Experimental Properties
- PSA: 120.85
- LogP: -1.45590
D-Aspartic acid,3-hydroxy-, (3S)- Related Literature
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Jieun Kim,Han-Saem Park,Tae-Hee Kim,Sung Yeol Kim,Hyun-Kon Song Phys. Chem. Chem. Phys., 2014,16, 5295-5300
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Xiang Liu,Qian Sun,A. B. Djuri?i?,Maohai Xie,Baohu Dai,Jinyao Tang,Charles Surya,Changzhong Liao,Kaimin Shih RSC Adv., 2015,5, 100783-100789
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Alvin Tanudjaja,Shinsuke Inagi,Fusao Kitamura,Toshikazu Takata,Ikuyoshi Tomita Dalton Trans., 2021,50, 3037-3043
-
Kathrin Kutlescha,Rhett Kempe New J. Chem., 2010,34, 1954-1960
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