Cas no 6037-45-2 (Trigalacturonic Acid (>90%))

Trigalacturonic Acid (>90%) structure
Trigalacturonic Acid (>90%) structure
Product Name:Trigalacturonic Acid (>90%)
CAS No:6037-45-2
MF:C18H26O19
MW:546.38764
MDL:MFCD00079573
CID:508381
PubChem ID:24900452
Update Time:2024-12-09

Trigalacturonic Acid (>90%) Chemical and Physical Properties

Names and Identifiers

    • Trigalacturonic Acid
    • 4)-O-a-D-galactopyranuronosyl-(1&reg
    • GALA-ALPHA1,4-GALA-ALPHA1,4GALA
    • GALACTURONIC ACID ALPHA1,4-GALACTURONIC ACID ALPHA1,4-GALACTURONIC ACID
    • O-galactopyranosyluronic acid-(1-4)-O-galactopyranosyluronic acid-(1-4)-galactopyranosyluronic acid
    • α-D-GalA-(1→4)-α-D-GalA-(1→4)-α-D-GalA
    • α-D-GalA-(1→4)-α-D-GalA-(1→4)-D-GalA
    • DTXSID90864153
    • alpha-D-Galactopyranuronosyl-(1->4)-alpha-D-galactopyranuronosyl-(1->4)-D-galacturonic acid
    • 9046-40-6
    • Hexopyranuronosyl-(1->4)hexopyranuronosyl-(1->4)hexopyranuronic acid
    • a-D-GalpA-(1->4)-a-D-galpa-(1->4)-a-D-galpa
    • 6-((2-carboxy-6-((2-carboxy-4,5,6-trihydroxyoxan-3-yl)oxy)-4,5-dihydroxyoxan-3-yl)oxy)-3,4,5-trihydroxyoxane-2-carboxylate
    • (2s,3r,4s,5r,6s)-6-(((2s,3r,4r,5r,6s)-2-carboxy-6-(((2s,3r,4r,5r,6s)-2-carboxy-4,5,6-trihydroxyoxan-3-yl)oxy)-4,5-dihydroxyoxan-3-yl)oxy)-3,4,5-trihydroxyoxane-2-carboxylic acid
    • G91076
    • DTXCID801012084
    • .ALPHA.-D-GALA-(1->4)-.ALPHA.-D-GALA-(1->4)-.ALPHA.-D-GALA
    • 6-((2-carboxy-6-((2-carboxy-4,5,6-trihydroxyoxan-3-yl)oxy)-4,5-dihydroxyoxan-3-yl)oxy)-3,4,5-trihydroxyoxane-2-carboxylic acid
    • (2s,3r,4s,5r,6s)-6-{[(2s,3r,4r,5r,6s)-2-carboxy-6-{[(2s,3r,4r,5r,6s)-2-carboxy-4,5,6-trihydroxyoxan-3-yl]oxy}-4,5-dihydroxyoxan-3-yl]oxy}-3,4,5-trihydroxyoxane-2-carboxylic acid
    • 1ST001119-100W
    • a-D-GalA-(1->4)-a-D-gala-(1->4)-a-D-gala
    • 6037-45-2
    • AKOS040755543
    • a-D-Galacturonosyl-(1->4)-a-D-galacturonosyl-(1->4)-a-D-galactnuronic acid
    • DTXSID60975780
    • 6-({2-carboxy-6-[(2-carboxy-4,5,6-trihydroxyoxan-3-yl)oxy]-4,5-dihydroxyoxan-3-yl}oxy)-3,4,5-trihydroxyoxane-2-carboxylic acid
    • (2S,3R,4R,5R,6S)-6-(((1S,2R,3R,4R)-1-Carboxy-1,3,4-trihydroxy-5-oxopentan-2-yl)oxy)-3-(((2S,3R,4S,5R,6S)-6-carboxy-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)oxy)-4,5-dihydroxytetrahydro-2H-pyran-2-carboxylic acid
    • a-D-Galacturonosyl-(1->4)-a-D-galacturonosyl-(1->4)-a-D-galactnuronate
    • Gala-(1-4)-gala-(1-4)-gala
    • PD043984
    • Q27264285
    • FMNDXLWVYMQMHF-XKLWFNJZSA-N
    • 68Y215MS20
    • 6-({2-carboxy-6-[(2-carboxy-4,5,6-trihydroxyoxan-3-yl)oxy]-4,5-dihydroxyoxan-3-yl}oxy)-3,4,5-trihydroxyoxane-2-carboxylate
    • UNII-68Y215MS20
    • (2S,3R,4S,5R,6S)-6-[(2S,3R,4R,5R,6S)-2-carboxy-6-[(1S,2R,3R,4R)-1-carboxy-1,3,4-trihydroxy-5-oxopentan-2-yl]oxy-4,5-dihydroxyoxan-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
    • alpha-D-Galacturonosyl-(1->4)-alpha-D-galacturonosyl-(1->4)-alpha-D-galactnuronate
    • alpha-Gala-gala-gala
    • a-D-Galactopyranuronosyl-(1->4)-a-D-galactopyranuronosyl-(1->4)-D-galacturonic acid
    • (2S,3R,4S,5R,6S)-6-[(2S,3R,4R,5R,6S)-2-Carboxy-6-[(2S,3R,4R,5R)-2-carboxy-4,5,6-trihydroxyoxan-3-yl]oxy-4,5-dihydroxyoxan-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
    • I+--D-galpa-(1->4)-I+--D-galpa-(1->4)-I+--D-galpa
    • D-Galacturonic acid, O-alpha-D-galactopyranuronosyl-(1-4)-O-alpha-D-galactopyranuronosyl-(1-4)-
    • Hexopyranuronosyl-(1->4)hexopyranuronosyl-(1->4)hexuronic acid
    • Trigalacturonic acid Solution in Water, 100ug/mL
    • Trigalacturonic Acid (>90%)
    • MDL: MFCD00079573
    • Inchi: InChI=1S/C18H26O19/c19-1-2(20)3(21)10(9(27)14(28)29)34-18-8(26)6(24)11(13(37-18)16(32)33)35-17-7(25)4(22)5(23)12(36-17)15(30)31/h1-13,17-18,20-27H,(H,28,29)(H,30,31)(H,32,33)/t2-,3+,4-,5+,6+,7+,8+,9-,10+,11+,12-,13-,17-,18-/m0/s1
    • InChI Key: FMNDXLWVYMQMHF-UHFFFAOYSA-N
    • SMILES: C(=O)[C@@H]([C@H]([C@H]([C@@H](C(=O)O)O)O[C@@H]1[C@@H]([C@H]([C@H]([C@H](O1)C(=O)O)O[C@@H]2[C@@H]([C@H]([C@H]([C@H](O2)C(=O)O)O)O)O)O)O)O)O

Computed Properties

  • Exact Mass: 546.10700
  • Monoisotopic Mass: 546.107
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 11
  • Hydrogen Bond Acceptor Count: 19
  • Heavy Atom Count: 37
  • Rotatable Bond Count: 11
  • Complexity: 836
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 14
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -6.1
  • Topological Polar Surface Area: 320?2

Experimental Properties

  • Density: 2.0±0.1 g/cm3
  • Melting Point: N/A℃
  • Boiling Point: 1051.2±65.0 °C at 760 mmHg
  • Flash Point: 358.8±27.8 °C
  • Refractive Index: 1.683
  • PSA: 319.89000
  • LogP: -7.29610
  • Vapor Pressure: 0.0±0.6 mmHg at 25°C

Trigalacturonic Acid (>90%) Security Information

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