(2r)-6-[(7-acetamido-1,2,3-trimethoxy-9-oxo-6,8-dihydro-5h-benzo[a]heptalen-10-yl)methylamino]-2-aminohexanoic acid (CHEM344476)
| Record Information | |||||||||
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| Version | 1.0 | ||||||||
| Creation Date | 2026-08-31 12:39:16 UTC | ||||||||
| Update Date | 2026-08-31 12:39:16 UTC | ||||||||
| Accession Number | CHEM344476 | ||||||||
| Identification | |||||||||
| Common Name | (2r)-6-[(7-acetamido-1,2,3-trimethoxy-9-oxo-6,8-dihydro-5h-benzo[a]heptalen-10-yl)methylamino]-2-aminohexanoic acid | ||||||||
| Class | Small Molecule | ||||||||
| Description | (2r)-6-[(7-acetamido-1,2,3-trimethoxy-9-oxo-6,8-dihydro-5h-benzo[a]heptalen-10-yl)methylamino]-2-aminohexanoic acid is a chemical compound with the formula C28H37N3O7. With an average molecular weight of 527.60 g/mol, (2r)-6-[(7-acetamido-1,2,3-trimethoxy-9-oxo-6,8-dihydro-5h-benzo[a]heptalen-10-yl)methylamino]-2-aminohexanoic acid is a heavy molecule. | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C28H37N3O7 | ||||||||
| Average Molecular Mass | Not Available | ||||||||
| Monoisotopic Mass | 527.263 g/mol | ||||||||
| CAS Registry Number | 77096-41-4 | ||||||||
| IUPAC Name | (2r)-6-[(7-acetamido-1,2,3-trimethoxy-9-oxo-6,8-dihydro-5h-benzo[a]heptalen-10-yl)methylamino]-2-aminohexanoic acid | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | CC(=O)NC1=C2CC(=O)C(=CC=C2C3=C(C(=C(C=C3CC1)OC)OC)OC)CNCCCCC(C(=O)O)N | ||||||||
| InChI Identifier | InChI=1S/C28H37N3O7/c1-16(32)31-22-11-9-17-13-24(36-2)26(37-3)27(38-4)25(17)19-10-8-18(23(33)14-20(19)22)15-30-12-6-5-7-21(29)28(34)35/h8,10,13,21,30H,5-7,9,11-12,14-15,29H2,1-4H3,(H,31,32)(H,34,35)/t21-/m1/s1 | ||||||||
| InChI Key | NRUWROYMQPJMPZ-OAQYLSRUSA-N | ||||||||
| Chemical Taxonomy | |||||||||
| Classification | Not classified | ||||||||
| Biological Properties | |||||||||
| Status | Detected and Not Quantified | ||||||||
| Origin | Not Available | ||||||||
| Cellular Locations | Not Available | ||||||||
| Biofluid Locations | Not Available | ||||||||
| Tissue Locations | Not Available | ||||||||
| Pathways | Not Available | ||||||||
| Applications | Not Available | ||||||||
| Biological Roles | Not Available | ||||||||
| Chemical Roles | Not Available | ||||||||
| Physical Properties | |||||||||
| State | Not Available | ||||||||
| Appearance | Not Available | ||||||||
| Experimental Properties |
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| Predicted Properties | Not Available | ||||||||
| Spectra | |||||||||
| Spectra |
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| Toxicity Profile | |||||||||
| Route of Exposure | Not Available | ||||||||
| Mechanism of Toxicity | Not Available | ||||||||
| Metabolism | Not Available | ||||||||
| Toxicity Values | Not Available | ||||||||
| Lethal Dose | Not Available | ||||||||
| Carcinogenicity (IARC Classification) | Not Available | ||||||||
| Uses/Sources | Not Available | ||||||||
| Minimum Risk Level | Not Available | ||||||||
| Health Effects | Not Available | ||||||||
| Symptoms | Not Available | ||||||||
| Treatment | Not Available | ||||||||
| Concentrations | |||||||||
| Not Available | |||||||||
| External Links | |||||||||
| Identifiers | Not Available | ||||||||
| References | |||||||||
| Synthesis Reference | Not Available | ||||||||
| MSDS | Not Available | ||||||||
| General References | Not Available | ||||||||
