Chitotriose Trihydrochloride - ≥98%(HPLC) , CAS No.41708-93-4

CAS: 41708-93-4 Cat. No.: C303684 Formula: C₁₈H₃₅N₃O₁₃•3HCl Peso molecolare: 610.86 PubChem CID: 121978

GRADE & PURITY ≥98%(HPLC)

Synonyms

Chitintriose|chitotriose|41708-93-4|(2R,3R,4R,5R)-2-AMINO-4-[(2R,3R,4R,5S,6R)-3-AMINO-5-[(2S,3R,4R,5S,6R)-3-AMINO-4,5-DIHYDROXY-6-(HYDROXYMETHYL)OXAN-2-YL]OXY-4-HYDROXY-6-(HYDROXYMETHYL)OXAN-2-YL]OXY-3,5,6-TRIHYDROXY-HEXANAL|(2R,3R,4S,5R)-2-amino-4-[(2S,3

Storage

Store at -20°C,Argon charged

Shipped In

Ice chest + Ice pads

Specifications

Sinonimi

Chitintriose | chitotriose | 41708-93-4 | (2R,3R,4R,5R)-2-AMINO-4-[(2R,3R,4R,5S,6R)-3-AMINO-5-[(2S,3R,4R,5S,6R)-3-AMINO-4,5-DIHYDROXY-6-(HYDROXYMETHYL)OXAN-2-YL]OXY-4-HYDROXY-6-(HYDROXYMETHYL)OXAN-2-YL]OXY-3,5,6-TRIHYDROXY-HEXANAL | (2R,3R,4S,5R)-2-amino-4-[(2S,3

Specifiche e purezza

≥98%(HPLC)

Condizioni di conservazione di stoccaggio

Store at -20°C,Argon charged

Spedito in

Ice chest + Ice pads

Questo prodotto richiede spedizione a catena fredda. I servizi di terra e altri servizi economici non sono disponibili.

Purezza

≥98%(HPLC)

Nomi e identificatori

Pubchem Sid

504756857

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504756857

Sorrisi canonici

C(C1C(C(C(C(O1)OC2C(OC(C(C2O)N)OC(C(CO)O)C(C(C=O)N)O)CO)N)O)O)O

IUPAC Name

(2R,3R,4S,5R)-2-amino-4-[(2S,3R,4R,5S,6R)-3-amino-5-[(2S,3R,4R,5S,6R)-3-amino-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,5,6-trihydroxyhexanal

InChIKey

HBAVVSYNWHLVDB-UDAFUQIYSA-N

INCHI

1S/C18H35N3O13/c19-5(1-22)11(27)15(6(26)2-23)33-18-10(21)14(30)16(8(4-25)32-18)34-17-9(20)13(29)12(28)7(3-24)31-17/h1,5-18,23-30H,2-4,19-21H2/t5-,6+,7+,8+,9+,10+,11+,12+,13+,14+,15+,16+,17-,18-/m0/s1

Isomeri SMILES

C([C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)O[C@@H]2[C@H](O[C@H]([C@@H]([C@H]2O)N)O[C@H]([C@@H](CO)O)[C@@H]([C@H](C=O)N)O)CO)N)O)O)O

CAS alternativo

117436-78-9

PubChem CID

121978

Peso molecolare

610.86

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Classe Organooxygen compounds
      • Subclass Carbohydrates and carbohydrate conjugates
        • Level5 Aminosaccharides
          • Level6 Aminoglycosides

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Classe: Organooxygen compounds
• Subclass: Carbohydrates and carbohydrate conjugates
• Intermediate Tree Nodes: Aminosaccharides
• Direct Parent: Aminoglycosides
• Alternative Parents: O-glycosyl compounds Disaccharides Oxanes Beta-hydroxy aldehydes Secondary alcohols 1,2-aminoalcohols Polyols Oxacyclic compounds Acetals Primary alcohols Organopnictogen compounds Organic oxides Monoalkylamines Hydrocarbon derivatives
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Aminoglycoside core - Disaccharide - Glycosyl compound - O-glycosyl compound - Beta-hydroxy aldehyde - Oxane - 1,2-aminoalcohol - Secondary alcohol - Oxacycle - Organoheterocyclic compound - Acetal - Polyol - Alcohol - Primary aliphatic amine - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organopnictogen compound - Organic nitrogen compound - Amine - Organonitrogen compound - Primary amine - Aldehyde - Primary alcohol - Aliphatic heteromonocyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as aminoglycosides. These are molecules or a portion of a molecule composed of amino-modified sugars.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Proprietà chimiche e fisiche

• Sensibilità: Moisture sensitive
• Peso molecolare: 501.500 g/mol
• XLogP3: -7.900
• Hydrogen Bond Donor Count: 11
• Hydrogen Bond Acceptor Count: 16
• Rotatable Bond Count: 11
• Exact Mass: 501.217 Da
• Monoisotopic Mass: 501.217 Da
• Topological Polar Surface Area: 294.000 Ų
• Heavy Atom Count: 34
• Formal Charge: 0
• Complexity: 636.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 14
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1