(2S,3S)-2,3-diaminobutanoic acid

Base Information

• Chemical Name: (2S,3S)-2,3-diaminobutanoic acid
• CAS No.: 80999-51-5
• Molecular Formula: C4H10N2O2
• Molecular Weight: 118.136
• UNII: ZM11K6TS42
• DSSTox Substance ID: DTXSID40472020
• Nikkaji Number: J337.828D
• Wikidata: Q82300762
• Mol file: 80999-51-5.mol

Synonyms:(2S,3S)-2,3-diaminobutanoic acid;80999-51-5;ZM11K6TS42;Butanoic acid, 2,3-diamino-, (2S,3S)-;2,3-Diaminobutyric acid, (2S,3S)-;(3S,2S)-2,3-DIAMINOBUTYRIC ACID;UNII-ZM11K6TS42;SCHEMBL2432506;DTXSID40472020;MFCD17012630;EN300-1719775;s(+)-beta-methyl-alpha,beta-diaminopropionic acid

Chemical Property of (2S,3S)-2,3-diaminobutanoic acid

Chemical Property:

• PSA: 89.34000
• LogP: 0.14610
• XLogP3: -3.2
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 118.074227566
• Heavy Atom Count: 8
• Complexity: 94

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C(C(=O)O)N)N
• Isomeric SMILES: C[C@@H]([C@@H](C(=O)O)N)N

Technology Process of (2S,3S)-2,3-diaminobutanoic acid

There total 6 articles about (2S,3S)-2,3-diaminobutanoic acid which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

totopotensamide A (1370031-21-2) → L-alanin (56-41-7,25191-17-7,18875-37-1) + D-allo-threonine (24830-94-2,134357-96-3,7013-32-3,82822-12-6) + L-isoleucine (73-32-5,959215-79-3,18875-42-8) + α,β-Diaminobuttersaeure (2643-66-5,25023-78-3,25023-80-7,80999-51-5,84122-94-1) + C9H10ClNO4

Guidance literature:

With hydrogenchloride; water; at 110 ℃; for 16h;

DOI:10.1021/np200886x

Reference yield:

totopotensamide B (1370031-22-3) → L-alanin (56-41-7,25191-17-7,18875-37-1) + D-allo-threonine (24830-94-2,134357-96-3,7013-32-3,82822-12-6) + L-isoleucine (73-32-5,959215-79-3,18875-42-8) + α,β-Diaminobuttersaeure (2643-66-5,25023-78-3,25023-80-7,80999-51-5,84122-94-1) + C9H10ClNO4

Guidance literature:

With hydrogenchloride; water; at 110 ℃; for 16h;

DOI:10.1021/np200886x

Reference yield:

mirabamide E (1268813-03-1) → L-alanin (56-41-7,25191-17-7,18875-37-1) + (2S,3R)-3-hydroxy-2-(methylamino)butanoic acid (2812-28-4) + C6H10ClNO2 + (2S,3S)-2,3-diaminobutanoic acid (80999-51-5) + D-o-methylserine (86118-11-8) + (-)-(2R,3R)-β-hydroxyleucine (87421-24-7) + (3S,4R)-3,4-dimethyl-L-glutamate

Guidance literature:

With hydrogenchloride; water; at 110 ℃; for 17h;

DOI:10.1021/np100613p

upstream raw materials:

totopotensamide A

totopotensamide B

mirabamide E

mirabamide F

Refernces

• 1、 Lu, Zhenyu,Van Wagoner, Ryan M.,Harper, Mary Kay,Baker, Heather L.,Hooper, John N. A.,Bewley, Carole A.,Ireland, Chris M.. "Mirabamides E-H, HIV-inhibitory depsipeptides from the sponge Stelletta clavosa". experimental part. p. 185 - 193. Retrieved 2011/04/26.