CAS 23668-11-3|Pactamycin
Introduction：Basic information about CAS 23668-11-3|Pactamycin, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Pactamycin | ||
|---|---|---|---|
| CAS Number | 23668-11-3 | Molecular Weight | 558.62300 |
| Density | 1.38g/cm3 | Boiling Point | 784.2ºC at 760mmHg |
| Molecular Formula | C28H38N4O8 | Melting Point | / |
| MSDS | USA | Flash Point | 428.1ºC |
| Symbol | GHS06 | Signal Word | Danger |
Names
| Name | Benzoic acid,2-hydroxy-6-methyl-,[(1S,2R,3R,4S,5S)-5-[(3-acetylphenyl)amino]-4-amino-3-[[(dimethylamino)carbonyl]amino]-1,2-dihydroxy-3-[(1S)-1-hydroxyethyl]-2-methylcyclopentyl]methylester |
|---|---|
| Synonym | More Synonyms |
Chemical & Physical Properties
| Density | 1.38g/cm3 |
|---|---|
| Boiling Point | 784.2ºC at 760mmHg |
| Molecular Formula | C28H38N4O8 |
| Molecular Weight | 558.62300 |
| Flash Point | 428.1ºC |
| Exact Mass | 558.26900 |
| PSA | 194.68000 |
| LogP | 1.91870 |
| Vapour Pressure | 6.66E-26mmHg at 25°C |
| Index of Refraction | 1.645 |
| InChIKey | WVIUOSJLUCTGFK-JUJPXXQGSA-N |
| SMILES | CC(=O)c1cccc(NC2C(N)C(NC(=O)N(C)C)(C(C)O)C(C)(O)C2(O)COC(=O)c2c(C)cccc2O)c1 |
Toxicological Information
CHEMICAL IDENTIFICATION |
ACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intravenous
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 1400 ug/kg
- TOXIC EFFECTS :
- Behavioral - food intake (animal) Gastrointestinal - other changes Liver - other changes
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 10 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 14 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intravenous
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 15600 ug/kg
- TOXIC EFFECTS :
- Behavioral - food intake (animal) Gastrointestinal - other changes Liver - other changes
- TYPE OF TEST :
- LDLo - Lowest published lethal dose
- ROUTE OF EXPOSURE :
- Unreported
- SPECIES OBSERVED :
- Mammal - dog
- DOSE/DURATION :
- 750 ug/kg
- TOXIC EFFECTS :
- Behavioral - food intake (animal) Gastrointestinal - other changes Liver - other changes
MUTATION DATA - TEST SYSTEM :
- Rodent - rat
- DOSE/DURATION :
- 6 mg/kg
- REFERENCE :
- RCOCB8 Research Communications in Chemical Pathology and Pharmacology. (PJD Pub. Ltd., P.O. Box 966, Westbury, NY 11590) V.1- 1970- Volume(issue)/page/year: 11,311,1975 *** REVIEWS *** TOXICOLOGY REVIEW CRTXB2 CRC Critical Reviews in Toxicology. (CRC Press, Inc., 2000 Corporate Blvd., NW, Boca Raton, FL 33431) V.1- 1971- Volume(issue)/page/year: 2,159,1973
- TEST SYSTEM :
- Rodent - rat
- DOSE/DURATION :
- 6 mg/kg
- REFERENCE :
- RCOCB8 Research Communications in Chemical Pathology and Pharmacology. (PJD Pub. Ltd., P.O. Box 966, Westbury, NY 11590) V.1- 1970- Volume(issue)/page/year: 11,311,1975 *** REVIEWS *** TOXICOLOGY REVIEW CRTXB2 CRC Critical Reviews in Toxicology. (CRC Press, Inc., 2000 Corporate Blvd., NW, Boca Raton, FL 33431) V.1- 1971- Volume(issue)/page/year: 2,159,1973
Safety Information
| Symbol | GHS06 |
|---|---|
| Signal Word | Danger |
| Hazard Statements | H300-H315-H319-H335 |
| Precautionary Statements | P261-P264-P301 + P310-P305 + P351 + P338 |
| RIDADR | UN 2811 6.1 / PGII |
Articles23
More Articles| Enantioselective synthesis of pactamycin, a complex antitumor antibiotic. Science 340(6129) , 180-2, (2013) Medicinal application of many complex natural products is precluded by the impracticality of their chemical synthesis. Pactamycin, the most structurally intricate aminocyclopentitol antibiotic, displa... | |
| Total synthesis of pactamycin and pactamycate: a detailed account. J. Org. Chem. 77(21) , 9458-72, (2012) This article describes synthetic studies that culminated in the first total synthesis of pactamycin and pactamycate and, in parallel, the two known congeners, de-6-MSA-pactamycin and de-6-MSA-pactamyc... | |
| Diastereocontrolled construction of pactamycin's complex ureido triol functional array. Org. Lett. 14(11) , 2878-81, (2012) An advanced intermediate in a projected synthesis of pactamycin has been prepared. Early installation of the C1-dimethylurea functionality allows for its participation in a diastereoselective, chelati... |
Synonyms
| Pactamycin |
