Cas no 6160-80-1 ((2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[(4-methyl-2-oxo-2H-chromen-7-yl)oxy]oxane-2-carboxylic acid)

(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[(4-methyl-2-oxo-2H-chromen-7-yl)oxy]oxane-2-carboxylic acid structure
6160-80-1 structure
Product Name:(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[(4-methyl-2-oxo-2H-chromen-7-yl)oxy]oxane-2-carboxylic acid
CAS No:6160-80-1
MF:C16H16O9
MW:352.292845726013
MDL:MFCD00036772
CID:46462
PubChem ID:329751679
Update Time:2025-07-13

(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[(4-methyl-2-oxo-2H-chromen-7-yl)oxy]oxane-2-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 4-methyl-2-oxo-2H-1-benzopyran-7-yl β-D-glucopyranosiduronic acid
    • 4-Methylumbelliferyl--D-glucuronide
    • MUG
    • 4-Methylumbelliferyl-beta-D-glucuronide
    • (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(4-methyl-2-oxochromen-7-yl)oxyoxane-2-carboxylic acid
    • 4-Methylumbelliferyl
    • 4-Methylumbelliferyl b-D-glucuronide dihydrate(MUG)
    • 4-Methylumbelliferyl β-D-Glucuronide
    • 4-METHYLUMBELLIFERYL-Β-D-GLUCURONIDE, MUGLCU
    • 4-Methylumbelliferyl-B-D-glucuronic acid
    • MUGlcU
    • 4-Methylumbelliferyl-β-D-glucuronide
    • 4-methyl-2-oxo-2H-1-benzopyran-7-yl-beta-D-glucopyranosiduronic acid
    • 4-Methylumbelliferyl glucuronide
    • 4-Methylumbelliferone glucuronide
    • MUG trihydrate
    • 4-Methylumbelliferyl beta-glucuronide
    • MolMap_000057
    • ARQXEQLMMNGFDU-JHZZJYKESA-N
    • 4-methylumbelliferone beta-d-glucuronide
    • ST044517
    • 4-Methyl-2-oxo-2H-1-benzopyran-7-yl beta-D-glucopyranosiduronic acid
    • (2S,3S,4S,6S,5R)-3,4,5-trihydroxy-6-(4-methyl-2-oxochromen-7-yloxy)-2H-3,4,5,6 -tetrahydropyran-2-carboxylic acid
    • (2S,3S,4S,5R,
    • (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[(4-methyl-2-oxo-2H-chromen-7-yl)oxy]oxane-2-carboxylic acid
    • MDL： MFCD00036772
    • Inchi： 1S/C16H16O9/c1-6-4-10(17)24-9-5-7(2-3-8(6)9)23-16-13(20)11(18)12(19)14(25-16)15(21)22/h2-5,11-14,16,18-20H,1H3,(H,21,22)/t11-,12-,13+,14-,16+/m0/s1
    • InChI Key： ARQXEQLMMNGFDU-JHZZJYKESA-N
    • SMILES： O1[C@H](C(=O)O)[C@H]([C@@H]([C@H]([C@@H]1OC1=CC=C2C(C)=CC(=O)OC2=C1)O)O)O

Computed Properties

  • Exact Mass: 352.07900
  • Monoisotopic Mass: 352.079
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 4
  • Hydrogen Bond Acceptor Count: 9
  • Heavy Atom Count: 25
  • Rotatable Bond Count: 3
  • Complexity: 574
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 5
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: -0.5
  • Topological Polar Surface Area: 143

Experimental Properties

  • Color/Form: White powder
  • Density: 1.632 g/cm3
  • Melting Point: 102 oC
  • Boiling Point: 683.1oC at 760 mmHg
  • Flash Point: 255oC
  • Water Partition Coefficient: Slightly soluble
  • PSA: 146.66000
  • LogP: -0.62760
  • Solubility: Slightly soluble in water.
  • Sensitiveness: Moisture Sensitive
  • Specific Rotation: -105 o (c=0.25, water 30 oC)

(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[(4-methyl-2-oxo-2H-chromen-7-yl)oxy]oxane-2-carboxylic acid Security Information

  • Hazardous Material transportation number：NONH for all modes of transport
  • WGK Germany：3
  • Hazard Category Code： 22-40
  • Safety Instruction： S24/25
  • Hazardous Material Identification： Xi
  • Safety Term：S24/25
  • Risk Phrases：R22
  • TSCA：Yes
  • Storage Condition：2-8°C

(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[(4-methyl-2-oxo-2H-chromen-7-yl)oxy]oxane-2-carboxylic acid Pricemore >>

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(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[(4-methyl-2-oxo-2H-chromen-7-yl)oxy]oxane-2-carboxylic acid Suppliers

NewCan Biotech Limited
Gold Member
Audited Supplier Audited Supplier
(CAS:6160-80-1)4-Methylumbelliferyl-beta-D-glucuronide
Order Number:NC13340
Stock Status:
Quantity:10g
Purity:97%
Pricing Information Last Updated:Friday, 18 July 2025 16:04
Price ($):Price inquiry

(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[(4-methyl-2-oxo-2H-chromen-7-yl)oxy]oxane-2-carboxylic acid Related Literature

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6160-80-1 ((2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[(4-methyl-2-oxo-2H-chromen-7-yl)oxy]oxane-2-carboxylic acid) Related Products

Recommended suppliers
NewCan Biotech Limited
(CAS:6160-80-1)4-Methylumbelliferyl-beta-D-glucuronide
NC13340
Purity:97%
Quantity:10g
Price ($):Inquiry
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