Name: Name:L-threo-α-D-galacto-Octopyranoside, methyl 7-chloro-6,7,8-trideoxy-6-[[(1-methyl-4-propyl-2-pyrrolidinyl)carbonyl]amino]-1-thio-, 3-(dihydrogen phosphate), (2S-trans)- (9CI)
Brand: Angene
SKU: AG002W79
Rating: 90 (10 reviews)

L-threo-α-D-galacto-Octopyranoside, methyl 7-chloro-6,7,8-trideoxy-6-[[(1-methyl-4-propyl-2-pyrrolidinyl)carbonyl]amino]-1-thio-, 3-(dihydrogen phosphate), (2S-trans)- (9CI)

CAS No.:

28708-34-1

Catalog Number:

AG002W79

Molecular Formula:

Molecular Weight:

Catalog Number:

AG002W79

Chemical Name:

L-threo-α-D-galacto-Octopyranoside, methyl 7-chloro-6,7,8-trideoxy-6-[[(1-methyl-4-propyl-2-pyrrolidinyl)carbonyl]amino]-1-thio-, 3-(dihydrogen phosphate), (2S-trans)- (9CI)

CAS Number:

28708-34-1

MDL Number:

MFCD21363518

IUPAC Name:

[(2R,3S,4S,5R,6R)-2-[(1S,2R)-2-chloro-1-[[(2S,4R)-1-methyl-4-propylpyrrolidine-2-carbonyl]amino]propyl]-3,5-dihydroxy-6-methylsulfanyloxan-4-yl] dihydrogen phosphate

InChI:

InChI=1S/C18H34ClN2O8PS/c1-5-6-10-7-11(21(3)8-10)17(24)20-12(9(2)19)15-13(22)16(29-30(25,26)27)14(23)18(28-15)31-4/h9-16,18,22-23H,5-8H2,1-4H3,(H,20,24)(H2,25,26,27)/t9-,10-,11+,12-,13+,14-,15-,16+,18-/m1/s1

InChI Key:

ZMGZEXFHZBYORP-SUXZLHENSA-N

Complexity:

658

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

504.146g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

504.96g/mol

Monoisotopic Mass:

504.146g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

174A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-1.2