Cas no 176166-22-6 (Phenylmethyl O-(N-Acetyl-α-neuraminosyl)-3-O-(β-D-galactopyranosyl)-4-[2-(acetylamino)-2-deoxy]-β-D-glucopyranoside)

Phenylmethyl O-(N-Acetyl-α-neuraminosyl)-3-O-(β-D-galactopyranosyl)-4-[2-(acetylamino)-2-deoxy]-β-D-glucopyranoside structure
176166-22-6 structure
Product Name:Phenylmethyl O-(N-Acetyl-α-neuraminosyl)-3-O-(β-D-galactopyranosyl)-4-[2-(acetylamino)-2-deoxy]-β-D-glucopyranoside
CAS No:176166-22-6
MF:C32H48N2O19
MW:764.7
CID:1062151
PubChem ID:156587990
Update Time:2024-11-06

Phenylmethyl O-(N-Acetyl-α-neuraminosyl)-3-O-(β-D-galactopyranosyl)-4-[2-(acetylamino)-2-deoxy]-β-D-glucopyranoside Chemical and Physical Properties

Names and Identifiers

    • Phenylmethyl O-(N-Acetyl-α-neuraminosyl)-3-O-(β-D-galactopyranosyl)-4-[2-(acetylamino)-2-deoxy]-β-D-glucopyranoside
    • Phenylmethyl O-(N-Acetyl-α-neuraminosyl)-3-O-(β-D-galactopyranosyl)-4-[2-(acetylamino)-2-deoxy]-β-D-
    • 176166-22-6
    • (2S,5R)-5-acetamido-2-[(2S,5S)-2-[(3S,6R)-5-acetamido-4-hydroxy-2-(hydroxymethyl)-6-phenylmethoxyoxan-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid
    • Phenylmethyl O-(N-Acetyl-alpha-neuraminosyl)-3-O-(beta-D-galactopyranosyl)-4-[2-(acetylamino)-2-deoxy]-beta-D-glucopyranoside
    • Inchi: 1S/C32H48N2O19/c1-13(38)33-20-16(40)8-32(31(46)47,52-27(20)22(42)17(41)9-35)53-28-23(43)18(10-36)49-30(25(28)45)51-26-19(11-37)50-29(21(24(26)44)34-14(2)39)48-12-15-6-4-3-5-7-15/h3-7,16-30,35-37,40-45H,8-12H2,1-2H3,(H,33,38)(H,34,39)(H,46,47)/t16?,17-,18?,19?,20-,21?,22-,23+,24?,25?,26-,27?,28?,29-,30+,32+/m1/s1
    • InChI Key: PGWZIARJSVVTOB-ZVFNIFTHSA-N
    • SMILES: C1([C@H](O)[C@H](O)CO)O[C@@](OC2C(O)[C@H](O[C@@H]3C(CO)O[C@@H](OCc4ccccc4)C(NC(C)=O)C3O)OC(CO)[C@@H]2O)(C(O)=O)CC(O)[C@H]1NC(C)=O

Computed Properties

  • Exact Mass: 764.28512731g/mol
  • Monoisotopic Mass: 764.28512731g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 12
  • Hydrogen Bond Acceptor Count: 19
  • Heavy Atom Count: 53
  • Rotatable Bond Count: 15
  • Complexity: 1210
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 8
  • Undefined Atom Stereocenter Count : 8
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -5.2
  • Topological Polar Surface Area: 333?2

Phenylmethyl O-(N-Acetyl-α-neuraminosyl)-3-O-(β-D-galactopyranosyl)-4-[2-(acetylamino)-2-deoxy]-β-D-glucopyranoside Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
P335765-1mg
Phenylmethyl O-(N-Acetyl-α-neuraminosyl)-3-O-(β-D-galactopyranosyl)-4-[2-(acetylamino)-2-deoxy]-β-D-glucopyranoside
176166-22-6
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$345.00 2023-05-17
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P335765-10mg
Phenylmethyl O-(N-Acetyl-α-neuraminosyl)-3-O-(β-D-galactopyranosyl)-4-[2-(acetylamino)-2-deoxy]-β-D-glucopyranoside
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P335765-25mg
Phenylmethyl O-(N-Acetyl-α-neuraminosyl)-3-O-(β-D-galactopyranosyl)-4-[2-(acetylamino)-2-deoxy]-β-D-glucopyranoside
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$ 27000.00 2023-09-06
SHENG KE LU SI SHENG WU JI SHU
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Phenylmethyl O-(N-Acetyl-α-neuraminosyl)-3-O-(β-D-galactopyranosyl)-4-[2-(acetylamino)-2-deoxy]-β-D-glucopyranoside,
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¥4,061.00 2023-07-11
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P335765-1mg
Phenylmethyl O-(N-Acetyl-α-neuraminosyl)-3-O-(β-D-galactopyranosyl)-4-[2-(acetylamino)-2-deoxy]-β-D-glucopyranoside
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¥3000.00 2023-09-15
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P335765-10mg
Phenylmethyl O-(N-Acetyl-α-neuraminosyl)-3-O-(β-D-galactopyranosyl)-4-[2-(acetylamino)-2-deoxy]-β-D-glucopyranoside
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¥24000.00 2023-09-15
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sc-477543-1mg
Phenylmethyl O-(N-Acetyl-α-neuraminosyl)-3-O-(β-D-galactopyranosyl)-4-[2-(acetylamino)-2-deoxy]-β-D-glucopyranoside,
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