Name: Name:D-erythro-α-L-gluco-2-Nonulopyranosonic acid, 5-(acetylamino)-5-deoxy-3-S-phenyl-3-thio-, methyl ester, 2,4,7,8,9-pentaacetate (9CI)
Brand: Angene
SKU: AG001OY1
Rating: 90 (10 reviews)

D-erythro-α-L-gluco-2-Nonulopyranosonic acid, 5-(acetylamino)-5-deoxy-3-S-phenyl-3-thio-, methyl ester, 2,4,7,8,9-pentaacetate (9CI)

CAS No.:

156726-98-6

Catalog Number:

AG001OY1

Molecular Formula:

Molecular Weight:

Catalog Number:

AG001OY1

Chemical Name:

D-erythro-α-L-gluco-2-Nonulopyranosonic acid, 5-(acetylamino)-5-deoxy-3-S-phenyl-3-thio-, methyl ester, 2,4,7,8,9-pentaacetate (9CI)

CAS Number:

156726-98-6

MDL Number:

MFCD23160237

IUPAC Name:

methyl (2S,3S,4S,5S)-5-acetamido-2,4-diacetyloxy-3-phenylsulfanyl-6-[(1S,2R)-1,2,3-triacetyloxypropyl]oxane-2-carboxylate

InChI:

InChI=1S/C28H35NO14S/c1-14(30)29-22-24(23(40-17(4)33)21(39-16(3)32)13-38-15(2)31)43-28(27(36)37-7,42-19(6)35)26(25(22)41-18(5)34)44-20-11-9-8-10-12-20/h8-12,21-26H,13H2,1-7H3,(H,29,30)/t21-,22+,23-,24?,25+,26+,28+/m1/s1

InChI Key:

NZFKVWJLAMASCK-IYUIIGPTSA-N

Complexity:

1090

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

641.178g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

641.641g/mol

Monoisotopic Mass:

641.178g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

221A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.1