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Alitame Hydrate structure, CAS 99016-42-9

Alitame Hydrate

CAS Number99016-42-9

Synonyms(3S)-3-amino-4-oxo-4-[[(2R)-2-[(2,2,4,4-tetramethylthietan-3-yl)amino]propanoyl]amino]butanoic acid pentahydrate; (3S)-3-amino-4-oxo-4-[[(2R)-1-oxo-2-[(2,2,4,4-tetramethyl-3-thietanyl)amino]propyl]amino]butanoic acid pentahydrate; (3S)-3-amino-4-keto-4-[[(2R)-2-[(2,2,4,4-tetramethylthietan-3-yl)amino]propanoyl]amino]butyric acid pentahydrate; (3S)-Amino-N-((1R)-1-((2,2,4,4-tetramethyl-3-thietanyl)carbamoy)ethyl)succinamic acid hydrate (2:5); Alitame [USAN]

Molecular FormulaC28H60N6O13S2

Molecular Weight376.47

Purity98%%

Density

Boiling Point608.5ºC at 760 mmHg

Melting Point

Flash Point

Appearance

EINECS

MSDSChineseEnglish

Symbol

Signal Word

Cat. No.: 2A-1201821 Purity: 98%%
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Quality Control of [ 99016-42-9 ] Purity: 98%% SDS Specification MoL

Chemical & Physical Properties
CAS Number99016-42-9
Catalog No.2A-1201821
Chinese NameL-天门冬酰-D-丙氨酰胺
Synonyms(3S)-3-amino-4-oxo-4-[[(2R)-2-[(2,2,4,4-tetramethylthietan-3-yl)amino]propanoyl]amino]butanoic acid pentahydrate; (3S)-3-amino-4-oxo-4-[[(2R)-1-oxo-2-[(2,2,4,4-tetramethyl-3-thietanyl)amino]propyl]amino]butanoic acid pentahydrate; (3S)-3-amino-4-keto-4-[[(2R)-2-[(2,2,4,4-tetramethylthietan-3-yl)amino]propanoyl]amino]butyric acid pentahydrate; (3S)-Amino-N-((1R)-1-((2,2,4,4-tetramethyl-3-thietanyl)carbamoy)ethyl)succinamic acid hydrate (2:5); Alitame [USAN]
Molecular FormulaC28H60N6O13S2
Molecular Weight376.47
Purity98%
Boiling Point608.5ºC at 760 mmHg
PubChem ID32961697
MDL NumberMFCD28101485
SMILESS2C(C(C2(C)C)N[C@H](C)C(=O)NC(=O)[C@@H](N)CC(=O)O)(C)C.S1C(C(C1(C)C)N[C@H](C)C(=O)NC(=O)[C@@H](N)CC(=O)O)(C)C.O.O.O.O.O
InChI1S/2C14H25N3O4S.5H2O/c2*1-7(16-12-13(2,3)22-14(12,4)5)10(20)17-11(21)8(15)6-9(18)19;;;;;/h2*7-8,12,16H,6,15H2,1-5H3,(H,18,19)(H,17,20,21);5*1H2/t2*7-,8+;;;;;/m11...../s1
InChI KeyCAGRXIUPBXSNBW-FLBSXDLDSA-N
NACRES CodeNA.24
UNSPSC41116107
MSDSmsds/203234_1_99016_42_9.pdf
Transport InfoProduct name: Alitame hydrate
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