59837-13-7 - Angene

p-Nitrophenyl 2-Acetamido-2-deoxy-3-O-(2,3,4,6-tetra-O-acetyl-β-D- galactopyranosyl)-α-D-galactopyranoside

CAS No.:

59837-13-7

Catalog Number:

AG00EEMJ

Molecular Formula:

Molecular Weight:

Catalog Number:

AG00EEMJ

Chemical Name:

p-Nitrophenyl 2-Acetamido-2-deoxy-3-O-(2,3,4,6-tetra-O-acetyl-β-D- galactopyranosyl)-α-D-galactopyranoside

CAS Number:

59837-13-7

MDL Number:

MFCD04973638

IUPAC Name:

[6-[5-acetamido-3-hydroxy-2-(hydroxymethyl)-6-(4-nitrophenoxy)oxan-4-yl]oxy-3,4,5-triacetyloxyoxan-2-yl]methyl acetate

InChI:

InChI=1S/C28H36N2O17/c1-12(32)29-21-24(22(37)19(10-31)45-27(21)44-18-8-6-17(7-9-18)30(38)39)47-28-26(43-16(5)36)25(42-15(4)35)23(41-14(3)34)20(46-28)11-40-13(2)33/h6-9,19-28,31,37H,10-11H2,1-5H3,(H,29,32)

InChI Key:

NULURJYXRHZLHJ-UHFFFAOYSA-N

Complexity:

1140

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

672.201g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

672.593g/mol

Monoisotopic Mass:

672.201g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

258A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-0.3