Maltotriitol - ≥95% , CAS No.32860-62-1

CAS: 32860-62-1 Cat. No.: M121091 분자식: C₁₈H₃₄O₁₆ 분자량: 506.45 EC 번호: 251-265-6

GRADE & PURITY ≥95%

Synonyms

Q27261130 | D-GLUCITOL, O-.ALPHA.-D-GLUCOPYRANOSYL-(1->4)-O-.ALPHA.-D-GLUCOPYRANOSYL-(1->4)- | (2S,3R,4R,5R)-4-{[(2R,3R,4R,5S,6R)-3,4-DIHYDROXY-6-(HYDROXYMETHYL)-5-{[(2R,3R,4S,5S,6R)-3,4,5-TRIHYDROXY-6-(HYDROXYMETHYL)OXAN-2-YL]OXY}OXAN-2-YL]OXY}HEXANE-1,2

Storage

Store at -20°C,Desiccated

Shipped In

Ice chest + Ice pads

개요

The presence of maltotriitol (C(18)H(34)O(16)) in maltose syrup is responsible for a change of the crystal morphology in the industrial crystallization process of maltitol (C(12)H(24)O(11)); Maltotriitol can be used as an inhibitor of acid production in human dental plaque.

Specifications

동의어

Q27261130 | D-GLUCITOL, O-.ALPHA.-D-GLUCOPYRANOSYL-(1->4)-O-.ALPHA.-D-GLUCOPYRANOSYL-(1->4)- | (2S,3R,4R,5R)-4-{[(2R,3R,4R,5S,6R)-3,4-DIHYDROXY-6-(HYDROXYMETHYL)-5-{[(2R,3R,4S,5S,6R)-3,4,5-TRIHYDROXY-6-(HYDROXYMETHYL)OXAN-2-YL]OXY}OXAN-2-YL]OXY}HEXANE-1,2

사양 및 순도

≥95%

보관 조건

Store at -20°C,Desiccated

배송

Ice chest + Ice pads

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순수함

≥95%

이름과 식별자

Pubchem Sid

504763517

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504763517

정식 스마일

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

IUPAC Name

(2S,3R,4R,5R)-4-[(2R,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxyhexane-1,2,3,5,6-pentol

InChIKey

XJCCHWKNFMUJFE-CGQAXDJHSA-N

INCHI

1S/C18H34O16/c19-1-5(23)9(25)15(6(24)2-20)33-18-14(30)12(28)16(8(4-22)32-18)34-17-13(29)11(27)10(26)7(3-21)31-17/h5-30H,1-4H2/t5-,6+,7+,8+,9+,10+,11-,12+,13+,14+,15+,16+,17+,18+/m0/s1

이성체 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)O)O[C@H]([C@@H](CO)O)[C@@H]([C@H](CO)O)O)CO)O)O)O)O

WGK 독일

3

분자량

506.45

Reaxy-Rn

4597263

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=4597263&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • 분류 Organooxygen compounds
      • Subclass Carbohydrates and carbohydrate conjugates

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• 분류: Organooxygen compounds
• Subclass: Carbohydrates and carbohydrate conjugates
• Intermediate Tree Nodes: Not available
• Direct Parent: Oligosaccharides
• Alternative Parents: Alkyl glycosides O-glycosyl compounds Fatty alcohols Sugar alcohols Oxanes Secondary alcohols Polyols Oxacyclic compounds Acetals Primary alcohols Hydrocarbon derivatives
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Oligosaccharide - Fatty acyl glycoside - Alkyl glycoside - Glycosyl compound - O-glycosyl compound - Fatty alcohol - Fatty acyl - Sugar alcohol - Oxane - Secondary alcohol - Organoheterocyclic compound - Acetal - Oxacycle - Polyol - Alcohol - Hydrocarbon derivative - Primary alcohol - Aliphatic heteromonocyclic compound
• 설명: This compound belongs to the class of organic compounds known as oligosaccharides. These are carbohydrates made up of 3 to 10 monosaccharide units linked to each other through glycosidic bonds.
• 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

화학 및 물리적 특성

• 감도: Moisture sensitive.
• 분자량: 506.500 g/mol
• XLogP3: -7.400
• Hydrogen Bond Donor Count: 12
• Hydrogen Bond Acceptor Count: 16
• Rotatable Bond Count: 11
• Exact Mass: 506.185 Da
• Monoisotopic Mass: 506.185 Da
• Topological Polar Surface Area: 280.000 Ų
• Heavy Atom Count: 34
• Formal Charge: 0
• Complexity: 598.000
• 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