Products 870891-89-7

CAS 870891-89-7 is the registry number for Blood Group H type II trisaccharide, spacer-biotin conjugate. Offered by: Biosynth. Available pack sizes: 1mg.

Structural formula: {0} (CAS {1})

N-[3-[(4R,5S)-3-acetamido-4-[(2R,4S,5R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,4S,5S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropyl]-6-[5-[(3aS)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoylamino]hexanamide (CAS 870891-89-7) is a chemical compound with the molecular formula C39H67N5O18S and a molecular weight of 926.0 g/mol. IUPAC name: N-[3-[(4R,5S)-3-acetamido-4-[(2R,4S,5R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,4S,5S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropyl]-6-[5-[(3aS)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoylamino]hexanamide. InChIKey: VNHSAYVGOFBMHH-NTGHKHQESA-N.

Identity
Molecular formulaC39H67N5O18S
Molecular weight926.0 g/mol
IUPAC nameN-[3-[(4R,5S)-3-acetamido-4-[(2R,4S,5R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,4S,5S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropyl]-6-[5-[(3aS)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoylamino]hexanamide
InChIKeyVNHSAYVGOFBMHH-NTGHKHQESA-N
SMILESCC1[C@H]([C@@H](C([C@@H](O1)OC2[C@H]([C@H](C(O[C@H]2O[C@H]3[C@@H](C(OC(C3NC(=O)C)OCCCNC(=O)CCCCCNC(=O)CCCCC4[C@@H]5C(CS4)NC(=O)N5)CO)O)CO)O)O)O)O)O

Computed by PubChem (NCBI)