Phleomycin D1

Chemical Information
Phleomycin D1 is a glycopeptide originally isolated from the bacterium Streptomyces verticillus which contains a (4'R)-4',5'-dihydro-2,4'-bi-1,3-thiazole-2',4-diyl moiety with a a 4-guanidylbutylaminocarbonyl group attached to the 4-position of the terminal thiazole ring. Like all phleomycins, phleomycin D1 can form complexes with redox-active metals such as Co, Cu, and Fe. It has a role as an antimicrobial agent, an antibacterial agent, an antineoplastic agent, an antifungal agent and a bacterial metabolite. It is a chelate-forming peptide, a glycopeptide, a member of guanidines, a bi-1,3-thiazole and a disaccharide derivative.
| CAS Number | 11031-11-1 |
| PubChem CID | 71668282 |
| 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-[(4R)-4-[4-[4-(diaminomethylideneamino)butylcarbamoyl]-1,3-thiazol-2-yl]-4,5-dihydro-1,3-thiazol-2-yl]ethylamino]-3-hydroxy-1-oxobutan-2-yl]amino]-3-hydroxy-4-methyl-5-oxopentan-2-yl]amino]-1-(1H-imidazol-5-yl)-3-oxopropoxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl] carbamate |
| Molecular Formula | C55H86N20O21S2 |
| Molecular Weight | 1427.5 |
| XLogP | -10.3 |
| Topological Polar Surface Area | 744 |
| Hydrogen Bond Donor Count | 22 |
| Hydrogen Bond Acceptor Count | 32 |
| Rotatable Bond Count | 37 |
| Heavy Atom Count | 98 |
| Formal Charge | 0 |
| Complexity | 2750 |
| Property | Value |
|---|---|
| Molecular Weight | 1427.5 |
| XLogP3 | -10.3 |
| Hydrogen Bond Donor Count | 22 |
| Hydrogen Bond Acceptor Count | 32 |
| Rotatable Bond Count | 37 |
| Exact Mass | 1426.57178218 |
| Monoisotopic Mass | 1426.57178218 |
| Topological Polar Surface Area | 744 Ų |
| Heavy Atom Count | 98 |
| Formal Charge | 0 |
| Complexity | 2750 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 20 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
Related Products
Alternative Products
| Catalog | Name |
|---|---|
| 41610028-2 | Phleomycin |
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