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| CAS No.: | 1402-82-0 |
|---|---|
| Name: | Amphomycin |
| Molecular Structure: | |
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| Formula: | C58H91N13O20 |
| Molecular Weight: | 1290.46 |
| Density: | 1.37g/cm3 |
| Boiling Point: | 1693.3°Cat760mmHg |
| Flash Point: | 977.9°C |
| Safety: | Poison by intravenous and intraperitoneal routes. Moderately toxic by ingestion. Induces hemolysis. Active against gram-positive bacteria. Suggested as a topical agent for animal and plant infections. When heated to decomposition it emits acrid smoke and irritating fumes. |
| PSA: | 506.84000 |
| LogP: | 0.52660 |
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Chemistry
IUPAC Name: 4-[[2-[[1-[[2-[[3-amino-1-[[3-methyl-1-[2-[(3-methyl-1,5-dioxo-2,3,4,7,8,9,10,10a-octahydropyrido[1,2-a][1,4]diazepin-4-yl)carbamoyl]pyrrolidin-1-yl]-1-oxobutan-2-yl]amino]-1-oxobutan-2-yl]amino]-2-oxoethyl]amino]-4-hydroxy-1,4-dioxobutan-2-yl]amino]-2-oxoethyl]amino]-3-[[4-hydroxy-2-[[4-hydroxy-2-[[(E)-10-methyldodec-3-enoyl]amino]-4-oxobutanoyl]-methylamino]-4-oxobutanoyl]amino]-4-oxobutanoic acid
Molecular Weight: 1290.41824 g/mol
Molecular Formula: C58H91N13O20
Density: 1.38 g/cm3
Boiling Point: 1627.2 °C at 760 mmHg
Flash Point: 937.9 °C
EINECS: 215-760-0
Molar Volume: 934.6 cm3
Polarizability: 126.95*10-24cm3
Surface Tension: 73.9 dyne/cm
Enthalpy of Vaporization: 275.44 kJ/mol
XLogP3-AA: -3.8
H-Bond Donor: 14
H-Bond Acceptor: 21
Rotatable Bond Count: 37
Tautomer Count: 512
Exact Mass: 1289.650332
MonoIsotopic Mass: 1289.650332
Topological Polar Surface Area: 498
Heavy Atom Count: 91
Complexity: 2710
Undefined Atom StereoCenter Count: 12
Defined Bond StereoCenter Count: 1
Covalently-Bonded Unit Count: 1
Isomeric SMILES: CCC(C)CCCCC/C=C/CC(=O)NC(CC(=O)O)C(=O)N(C)C(CC(=O)O)C(=O)NC(CC(=O)O)C(=
O)NCC(=O)NC(CC(=O)O)C(=O)NCC(=O)NC(C(C)N)C(=O)NC(C(C)C)C(=O)N1CCCC1C(=O)NC2C(NC(=O)C3CCCCN3C2=O)C
InChIKey: AQZKCOXFXDOYRA-WYMLVPIESA-N
Toxicity Data With Reference
| 1. | orl-mus LD50:500 mg/kg | 85GDA2 CRC Handbook of Antibiotic Compounds. 4 (1)(1980),317. | ||
| 2. | ipr-mus LD50:233 mg/kg | CNCRA6 Cancer Chemotherapy Reports. 30 (1963),9. | ||
| 3. | ivn-mus LD50:178 mg/kg | 85FZAT Index of Antibiotics from Actinomycetes Umezawa, H., et al., eds.,Tokyo, Japan.: University of Tokyo Press,1967,131. |
Safety Profile
Poison by intravenous and intraperitoneal routes. Moderately toxic by ingestion. Induces hemolysis. Active against gram-positive bacteria. Suggested as a topical agent for animal and plant infections. When heated to decomposition it emits acrid smoke and irritating fumes.
Specification
Amphomycin (CAS NO.1402-82-0) is also called Amfomycin ; Amfomycine [INN-French] ; Amfomycinum [INN-Latin] ;
Anfomicina [INN-Spanish] . Amphomycin (CAS NO.1402-82-0) is high toxic. It is flammable. Amphomycin (CAS NO.1402-82-0) will produce toxic Nitrogen oxide fumes by heat. So the storage environment should be ventilate, low-temperature and dry.