for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Room temperature Ships Check lot-specific COA for exact specifications.
SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| ALogP | -8.9 |
|---|
| Canonical Smiles | CC1=C(N=C(N=C1N)C(CC(=O)N)NCC(C(=O)N)N)C(=O)NC(C(C2=CN=CN2)OC3C(C(C(C(O3)CO)O)O)OC4C(C(C(C(O4)CO)O)OC(=O)N)O)C(=O)NC(C)C(C(C)C(=O)NC(C(C)O)C(=O)NCCC5=NC(=CS5)C6=NC(=CS6)C(=O)NCCCNCCCCNCCCN)O |
|---|---|
| IUPAC Name | [(2R,3S,4S,5R,6R)-2-[(2R,3S,4S,5S,6S)-2-[(1R,2S)-2-[[6-amino-2-[(1S)-3-amino-1-[[(2S)-2,3-diamino-3-oxopropyl]amino]-3-oxopropyl]-5-methylpyrimidine-4-carbonyl]amino]-3-[[(2R,3S,4S)-5-[[(2S,3R)-1-[2-[4-[4-[3-[4-(3-aminopropylamino)butylamino]propylcarbamo |
| InChIKey | FOUFFVYWFNBHHH-YNGSZULRSA-N |
| INCHI | 1S/C60H96N20O21S2/c1-25-38(77-51(80-49(25)64)30(17-36(63)84)72-18-29(62)50(65)90)55(94)79-40(46(31-19-69-24-73-31)99-59-48(44(88)42(86)34(20-81)98-59)100-58-45(89)47(101-60(66)96)43(87)35(21-82)97-58)56(95)74-27(3)41(85)26(2)52(91)78-39(28(4)83)54(9 |
| Isomeric SMILES | CC1=C(N=C(N=C1N)[C@H](CC(=O)N)NC[C@@H](C(=O)N)N)C(=O)N[C@@H]([C@H](C2=CN=CN2)O[C@H]3[C@H]([C@H]([C@@H]([C@@H](O3)CO)O)O)O[C@@H]4[C@H]([C@H]([C@@H]([C@H](O4)CO)O)OC(=O)N)O)C(=O)N[C@H](C)[C@H]([C@H](C)C(=O)N[C@@H]([C@@H](C)O)C(=O)NCCC5=NC(=CS5)C6=NC(=CS6)C(=O)NCCCNCCCCNCCCN)O |
| PubChem CID | 9877229 |
| Molecular Weight | 1497.7 |
Comprehensive hazard, handling, storage, and regulatory compliance document.
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View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organic acids and derivatives |
| Class | Peptidomimetics |
| Subclass | Hybrid peptides |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Hybrid glycopeptides |
| Alternative Parents | Histidine and derivatives Fatty acyl glycosides of mono- and disaccharides N-acyl-alpha amino acids and derivatives Gamma amino acids and derivatives Alpha amino acid amides Beta amino acids and derivatives Disaccharides O-glycosyl compounds Pyrimidinecarboxylic acids and derivatives 2-heteroaryl carboxamides Thiazolecarboxamides Aminopyrimidines and derivatives Aralkylamines 2,4-disubstituted thiazoles Oxanes N-acyl amines Imidolactams Carbamate esters Heteroaromatic compounds Imidazoles Organic carbonic acids and derivatives Secondary carboxylic acid amides Primary carboxylic acid amides Secondary alcohols Dialkylamines Azacyclic compounds Oxacyclic compounds Acetals Monoalkylamines Organic oxides Carbonyl compounds Organopnictogen compounds Primary alcohols Hydrocarbon derivatives |
| Molecular Framework | Aromatic heteromonocyclic compounds |
| Substituents | Hybrid glycopeptide - Histidine or derivatives - Fatty acyl glycoside - Fatty acyl glycoside of mono- or disaccharide - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Gamma amino acid or derivatives - Disaccharide - O-glycosyl compound - Beta amino acid or derivatives - Glycosyl compound - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Pyrimidine-6-carboxylic acid or derivatives - Thiazolecarboxylic acid or derivatives - Thiazolecarboxamide - 2-heteroaryl carboxamide - Aralkylamine - 2,4-disubstituted 1,3-thiazole - Aminopyrimidine - Oxane - Imidolactam - N-acyl-amine - Fatty amide - Pyrimidine - Fatty acyl - Heteroaromatic compound - Imidazole - Azole - Carbamic acid ester - Thiazole - Amino acid or derivatives - Secondary carboxylic acid amide - Carbonic acid derivative - Carboxamide group - Secondary alcohol - Primary carboxylic acid amide - Acetal - Oxacycle - Azacycle - Organoheterocyclic compound - Secondary amine - Carboxylic acid derivative - Secondary aliphatic amine - Organopnictogen compound - Carbonyl group - Organic oxygen compound - Alcohol - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Amine - Primary amine - Primary alcohol - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Aromatic heteromonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as hybrid glycopeptides. These are compounds containing a carbohydrate component linked to a hybrid peptide component. |
| External Descriptors | Not available |
| Molecular Weight | 1497.700 g/mol |
|---|---|
| XLogP3 | -8.900 |
| Hydrogen Bond Donor Count | 23 |
| Hydrogen Bond Acceptor Count | 34 |
| Rotatable Bond Count | 44 |
| Exact Mass | 1496.65 Da |
| Monoisotopic Mass | 1496.65 Da |
| Topological Polar Surface Area | 734.000 Ų |
| Heavy Atom Count | 103 |
| Formal Charge | 0 |
| Complexity | 2690.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 19 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
