Account sodium 5-acetamido-2-((6-((5-acetamido-6-((2-((2-(((3-((3-acetamido-5-((6-(((5-acetamido-2-carboxylato-4-hydroxy-6-((1R,2R)-1,2,3-trihydroxypropyl)tetrahydro-2H-pyran-2-yl)oxy)methyl)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)oxy)-4-hydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)methyl)-6-((5-acetamido-6-((5-acetamido-6-((S)-4-(((S)-6-amino-1-(((1S,2R)-1-carboxy-2-hydroxypropyl)amino)-1-oxohexan-2-yl)amino)-3-((S)-2-((S)-2-((S)-2,6-diaminohexanamido)-3-methylbutanamido)propanamido)-4-oxobutanamido)-4-hydroxy-2-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)oxy)-4-hydroxy-2-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)oxy)-3,5-dihydroxytetrahydro-2H-pyran-4-yl)oxy)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)oxy)-4-hydroxy-2-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)methoxy)-4-hydroxy-6-((1R,2R)-1,2,3-trihydroxypropyl)tetrahydro-2H-pyran-2-carboxylate
- Catalog No. :
- ACTFZB586
- CAS No. :
- 189035-43-6
- Molecular Formula :
- C112H187N15Na2O70
- Molecular Weight :
- 2909.74
IUPAC Name:sodium 5-acetamido-2-((6-((5-acetamido-6-((2-((2-(((3-((3-acetamido-5-((6-(((5-acetamido-2-carboxylato-4-hydroxy-6-((1R,2R)-1,2,3-trihydroxypropyl)tetrahydro-2H-pyran-2-yl)oxy)methyl)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)oxy)-4-hydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)methyl)-6-((5-acetamido-6-((5-acetamido-6-((S)-4-(((S)-6-amino-1-(((1S,2R)-1-carboxy-2-hydroxypropyl)amino)-1-oxohexan-2-yl)amino)-3-((S)-2-((S)-2-((S)-2,6-diaminohexanamido)-3-methylbutanamido)propanamido)-4-oxobutanamido)-4-hydroxy-2-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)oxy)-4-hydroxy-2-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)oxy)-3,5-dihydroxytetrahydro-2H-pyran-4-yl)oxy)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)oxy)-4-hydroxy-2-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)methoxy)-4-hydroxy-6-((1R,2R)-1,2,3-trihydroxypropyl)tetrahydro-2H-pyran-2-carboxylate
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| Product Name | sodium 5-acetamido-2-((6-((5-acetamido-6-((2-((2-(((3-((3-acetamido-5-((6-(((5-acetamido-2-carboxylato-4-hydroxy-6-((1R,2R)-1,2,3-trihydroxypropyl)tetrahydro-2H-pyran-2-yl)oxy)methyl)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)oxy)-4-hydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)methyl)-6-((5-acetamido-6-((5-acetamido-6-((S)-4-(((S)-6-amino-1-(((1S,2R)-1-carboxy-2-hydroxypropyl)amino)-1-oxohexan-2-yl)amino)-3-((S)-2-((S)-2-((S)-2,6-diaminohexanamido)-3-methylbutanamido)propanamido)-4-oxobutanamido)-4-hydroxy-2-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)oxy)-4-hydroxy-2-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)oxy)-3,5-dihydroxytetrahydro-2H-pyran-4-yl)oxy)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)oxy)-4-hydroxy-2-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)methoxy)-4-hydroxy-6-((1R,2R)-1,2,3-trihydroxypropyl)tetrahydro-2H-pyran-2-carboxylate |
|---|---|
| IUPAC Name | sodium 5-acetamido-2-((6-((5-acetamido-6-((2-((2-(((3-((3-acetamido-5-((6-(((5-acetamido-2-carboxylato-4-hydroxy-6-((1R,2R)-1,2,3-trihydroxypropyl)tetrahydro-2H-pyran-2-yl)oxy)methyl)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)oxy)-4-hydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)methyl)-6-((5-acetamido-6-((5-acetamido-6-((S)-4-(((S)-6-amino-1-(((1S,2R)-1-carboxy-2-hydroxypropyl)amino)-1-oxohexan-2-yl)amino)-3-((S)-2-((S)-2-((S)-2,6-diaminohexanamido)-3-methylbutanamido)propanamido)-4-oxobutanamido)-4-hydroxy-2-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)oxy)-4-hydroxy-2-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)oxy)-3,5-dihydroxytetrahydro-2H-pyran-4-yl)oxy)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)oxy)-4-hydroxy-2-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)methoxy)-4-hydroxy-6-((1R,2R)-1,2,3-trihydroxypropyl)tetrahydro-2H-pyran-2-carboxylate |
| Molecular Formula | C112H187N15Na2O70 |
| Molecular Weight | 2909.74 |
| SMILES | CC(=O)NC1C(NC(=O)C[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H](N)CCCCN)C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)[C@@H](C)O)OC(CO)C(OC2OC(CO)C(OC3OC(COC4OC(CO)C(O)C(O)C4OC4OC(CO)C(OC5OC(COC6(C(=O)[O-])CC(O)C(NC(C)=O)C([C@H](O)[C@H](O)CO)O6)C(O)C(O)C5O)C(O)C4NC(C)=O)C(O)C(OC4OC(CO)C(O)C(O)C4OC4OC(CO)C(OC5OC(COC6(C(=O)[O-])CC(O)C(NC(C)=O)C([C@H](O)[C@H](O)CO)O6)C(O)C(O)C5O)C(O)C4NC(C)=O)C3O)C(O)C2NC(C)=O)C1O.[Na+].[Na+] |
| InChI Key | KMJYGLJORYOCJF-OABTZWTBSA-L |
| Synonym | SIALYLGLYCOPEPTIDE;SGP;Sialylglycopeptides;Sialylglycopeptide >L-Threonine, L-lysyl-L-valyl-L-alanyl-N-[O-(N-acetyl-α-neuraminosyl)-(2→6)-O-β-D-galactopyranosyl-(1→4)-O-2-(acetylamino)-2-deoxy-β-D-glucopyranosyl-(1→2)-O-α-D-mannopyranosyl-(1→3)-O-[O-(N-acetyl-α-neuraminosyl)-(2→6)-O-β-D-galactopyranosyl-(1→4)-O-2-(acetylamino)-2-deoxy-β-D-glucopyranosyl-(1→2)-α...;NH2-Lys-Val-Ala-{[1,2,3-13C3]NeuNAcα2,3Galβ1,4GlcNAcβ1,2Manα1,3 ([1,2,3-13C3]NeuNAcα2,3Galβ1,4GlcNAcβ1,2Manα1,6)Manβ1,4GlcNAcβ1,4GlcNAcβ-}-Asn-Lys-Thr-COOH;SIALYLGLYCOPEPTIDE USP/EP/BP;SGP[S2G2-peptide |
| CAS No. | 189035-43-6 |
Synthetic Route by SureRoute
2. ACTFZB586 Molecular Building Block Synthetic Route
N2-L-lysyl-L-valyl-L-alanyl-N4-((2R,3R,4R,5S,6R)-3-acetamido-5-(((2S,3R,4R,5S,6R)-3-acetamido-5-(((2S,3S,4S,5R,6R)-4-(((2R,3S,4S,5S,6R)-3-(((2S,3R,4R,5S,6R)-3-acetamido-4-hydroxy-6-(hydroxymethyl)-5-(((2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)oxy)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-6-((((2S,3S,4S,5S,6R)-3-(((2S,3R,4R,5S,6R)-3-acetamido-4-hydroxy-6-(hydroxymethyl)-5-(((2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)oxy)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)methyl)-3,5-dihydroxytetrahydro-2H-pyran-2-yl)oxy)-4-hydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-4-hydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)-L-asparaginyl-L-lysyl-L-threonine
Neu5Gcα(2-6) N-Glycan-Asn
G0 N-glycan-Asn