Cas no 93979-06-7 (4-Nitrophenyl 3-O-(a-D-Mannopyranosyl)-a-D-mannopyranoside)

4-Nitrophenyl 3-O-(a-D-Mannopyranosyl)-a-D-mannopyranoside structure
93979-06-7 structure
Product Name:4-Nitrophenyl 3-O-(a-D-Mannopyranosyl)-a-D-mannopyranoside
CAS No:93979-06-7
MF:C18H25NO13
MW:463.390006780624
CID:797556
PubChem ID:29985541
Update Time:2025-04-19

4-Nitrophenyl 3-O-(a-D-Mannopyranosyl)-a-D-mannopyranoside Chemical and Physical Properties

Names and Identifiers

    • 4-Nitrophenyl 3-O-(α-D-Mannopyranosyl)-α-D-mannopyranoside
    • 4-NITROPHENYL 3-O-(A-D-MANNOPYRANOSYL)-A-D-MANNOPYRANOSIDE
    • a-D-Mannopyranoside, 4-nitrophenyl3-O-a-D-mannopyranosyl-
    • MAN1-A-3MAN-A-OPNP
    • 93979-06-7
    • W-204095
    • (2R,3S,4S,5S,6R)-2-(((2R,3R,4S,5S,6R)-3,5-Dihydroxy-2-(hydroxymethyl)-6-(4-nitrophenoxy)tetrahydro-2H-pyran-4-yl)oxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol
    • (2R,3S,4S,5S,6R)-2-[(2R,3R,4S,5S,6R)-3,5-dihydroxy-2-(hydroxymethyl)-6-(4-nitrophenoxy)oxan-4-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
    • (2R,3S,4S,5S,6R)-2-((2R,3R,4S,5S,6R)-3,5-dihydroxy-2-(hydroxymethyl)-6-(4-nitrophenoxy)tetrahydro-2H-pyran-4-yloxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol
    • Man1-alpha-3Man-alpha-OPNP
    • 4-Nitrophenyl 3-O-( alpha -D-Mannopyranosyl)- alpha -D-mannopyranoside
    • (2R,3S,4S,5S,6R)-2-{[(2R,3R,4S,5S,6R)-3,5-DIHYDROXY-2-(HYDROXYMETHYL)-6-(4-NITROPHENOXY)OXAN-4-YL]OXY}-6-(HYDROXYMETHYL)OXANE-3,4,5-TRIOL
    • 4-Nitrophenyl 3-O-(a-D-Mannopyranosyl)-a-D-mannopyranoside
    • Inchi： 1S/C18H25NO13/c20-5-9-11(22)13(24)14(25)17(30-9)32-16-12(23)10(6-21)31-18(15(16)26)29-8-3-1-7(2-4-8)19(27)28/h1-4,9-18,20-26H,5-6H2/t9-,10-,11-,12-,13+,14+,15+,16+,17-,18+/m1/s1
    • InChI Key： LBTDRWMZFQVCAR-TZXJRDDMSA-N
    • SMILES： O([C@@H]1[C@H]([C@H]([C@@H]([C@@H](CO)O1)O)O)O)[C@@H]1[C@@H]([C@@H](OC2C=CC(=CC=2)[N+](=O)[O-])O[C@H](CO)[C@H]1O)O

Computed Properties

  • Exact Mass: 463.13300
  • Monoisotopic Mass: 463.13258985g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 7
  • Hydrogen Bond Acceptor Count: 13
  • Heavy Atom Count: 32
  • Rotatable Bond Count: 6
  • Complexity: 612
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 10
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -2
  • Topological Polar Surface Area: 224?2

Experimental Properties

  • Density: 1.70±0.1 g/cm3 (20 oC 760 Torr),
  • Melting Point: 144-148°C
  • Solubility: Slightly soluble (1.9 g/l) (25 o C),
  • Stability/Shelf Life: Light, Moisture and Temperature Sensitive
  • PSA: 224.35000
  • LogP: -2.87910

4-Nitrophenyl 3-O-(a-D-Mannopyranosyl)-a-D-mannopyranoside Pricemore >>

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4-Nitrophenyl 3-O-(a-D-mannopyranosyl)-a-D-mannopyranoside
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EN04837-25 mg
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