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 | 2.6 |
|---|
| Canonical Smiles | CCC1(C2=C(COC1=O)C(=O)N3CC4=CC5=CC=CC=C5N=C4C3=C2)OC(=O)C(C(C)C)NC(=O)C(CC6=CN=CN6)NC(=S)NC7=CC=C(C=C7)OC8C(C(C(C(O8)C)O)OC)O |
|---|---|
| IUPAC Name | [(19S)-19-ethyl-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15(20)-heptaen-19-yl] (2S)-2-[[(2S)-2-[[4-[(2R,3S,4R,5R,6S)-3,5-dihydroxy-4-methoxy-6-methyloxan-2-yl]oxyphenyl]carbamothioylamino]-3-(1H-imidazol-5 |
| InChIKey | SLOJCSGNHWIKIG-JNYZSSQASA-N |
| INCHI | 1S/C45H49N7O11S/c1-6-45(30-17-33-35-25(15-24-9-7-8-10-31(24)49-35)19-52(33)40(56)29(30)20-60-43(45)58)63-41(57)34(22(2)3)51-39(55)32(16-27-18-46-21-47-27)50-44(64)48-26-11-13-28(14-12-26)62-42-37(54)38(59-5)36(53)23(4)61-42/h7-15,17-18,21-23,32,34,3 |
| Isomeric SMILES | CC[C@@]1(C2=C(COC1=O)C(=O)N3CC4=CC5=CC=CC=C5N=C4C3=C2)OC(=O)[C@H](C(C)C)NC(=O)[C@H](CC6=CN=CN6)NC(=S)NC7=CC=C(C=C7)O[C@@H]8[C@H]([C@@H]([C@@H]([C@@H](O8)C)O)OC)O |
| PubChem CID | 9941008 |
| Molecular Weight | 896 |
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 | Depsipeptides |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Glycodepsipeptides |
| Alternative Parents | Camptothecins Histidine and derivatives Phenolic glycosides Alpha amino acid esters Valine and derivatives N-acyl-alpha amino acids and derivatives Hexoses Alpha amino acid amides O-glycosyl compounds Pyranopyridines Quinolines and derivatives N-phenylthioureas Phenoxy compounds Phenol ethers Imidazolyl carboxylic acids and derivatives Fatty acid esters Pyridinones Fatty amides Oxanes Dicarboxylic acids and derivatives Heteroaromatic compounds Secondary alcohols Thioureas Secondary carboxylic acid amides Lactams Lactones Carboxylic acid esters Oxacyclic compounds Azacyclic compounds Acetals Dialkyl ethers Organic oxides Carbonyl compounds Organonitrogen compounds Organopnictogen compounds Hydrocarbon derivatives |
| Molecular Framework | Aromatic heteropolycyclic compounds |
| Substituents | Glycodepsipeptide - Camptothecin - Histidine or derivatives - Phenolic glycoside - Alpha-amino acid ester - Valine or derivatives - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Hexose monosaccharide - Glycosyl compound - O-glycosyl compound - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - N-phenylthiourea - Pyranopyridine - Quinoline - Alkaloid or derivatives - Imidazolyl carboxylic acid derivative - Phenol ether - Phenoxy compound - Fatty acid ester - Pyridinone - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Monosaccharide - Fatty amide - Dicarboxylic acid or derivatives - Oxane - Pyridine - Azole - Heteroaromatic compound - Imidazole - Carboxamide group - Thiourea - Secondary alcohol - Secondary carboxylic acid amide - Carboxylic acid ester - Lactam - Lactone - Acetal - Oxacycle - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Dialkyl ether - Ether - Carbonyl group - Organic nitrogen compound - Alcohol - Hydrocarbon derivative - Organic oxygen compound - Organopnictogen compound - Organosulfur compound - Organic oxide - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound |
| Description | This compound belongs to the class of organic compounds known as glycodepsipeptides. These are compounds in which a carbohydrate component is linked to a depsipeptide component. |
| External Descriptors | Not available |
| Molecular Weight | 896.000 g/mol |
|---|---|
| XLogP3 | 2.600 |
| Hydrogen Bond Donor Count | 6 |
| Hydrogen Bond Acceptor Count | 14 |
| Rotatable Bond Count | 14 |
| Exact Mass | 895.321 Da |
| Monoisotopic Mass | 895.321 Da |
| Topological Polar Surface Area | 268.000 Ų |
| Heavy Atom Count | 64 |
| Formal Charge | 0 |
| Complexity | 1840.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 8 |
| 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 |
