Cas no 681230-43-3 (D-Isoleucine, 4-hydroxy-, (4R)-)
681230-43-3 structure
Product Name:D-Isoleucine, 4-hydroxy-, (4R)-
CAS No:681230-43-3
MF:C6H13NO3
MW:147.172322034836
CID:6644093
PubChem ID:11708073
Update Time:2024-03-02
D-Isoleucine, 4-hydroxy-, (4R)- Chemical and Physical Properties
Names and Identifiers
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- 681230-43-3
- DTXSID50470911
- SCHEMBL3574094
- D-Isoleucine, 4-hydroxy-, (4R)-
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- Inchi： 1S/C6H13NO3/c1-3(4(2)8)5(7)6(9)10/h3-5,8H,7H2,1-2H3,(H,9,10)/t3-,4-,5-/m1/s1
- InChI Key： OSCCDBFHNMXNME-UOWFLXDJSA-N
- SMILES： O[C@H](C)[C@@H](C)[C@H](C(=O)O)N
Computed Properties
- Exact Mass: 147.08954328g/mol
- Monoisotopic Mass: 147.08954328g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 10
- Rotatable Bond Count: 3
- Complexity: 126
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 3
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -2.8
- Topological Polar Surface Area: 83.6?2
D-Isoleucine, 4-hydroxy-, (4R)- Related Literature
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
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