(-)-Gusperimus
Grundinformationen
- CAS
89149-10-0- Standard-SMILES
NCCCNCCCCNC(=O)[C@H](O)NC(=O)CCCCCCN=C(N)N- InChIKey
IDINUJSAMVOPCM-INIZCTEOSA-N- Summenformel
- C17H37N7O3
- Durchschnittliche Molmasse
- 387,5 g/mol
- Monoisotopische Masse
- 387,29578807
Überblick
Deoxyspergualin has been used in trials studying the treatment of Lupus Nephritis, Chronic Rejection, and Diabetes Mellitus, Type 1.
Namen und Bezeichner
- Bevorzugter Name
- (-)-Gusperimus
- IUPAC
- N-[(1S)-2-[4-(3-aminopropylamino)butylamino]-1-hydroxy-2-oxoethyl]-7-(diaminomethylideneamino)heptanamide
- Englischer Name
- (S)-15-Deoxyspergualin
- Molmasse
- 0
Namen und Synonyme
Deoxyspergualin(-)-15-Deoxyspergualin(-)-Gusperimus89149-10-057F9XM233RHeptanamide, 7-((aminoiminomethyl)amino)-N-((1S)-2-((4-((3-aminopropyl)amino)butyl)amino)-1-hydroxy-2-oxoethyl)-DTXSID70237548Heptanamide, 7-((aminoiminomethyl)amino)-N-(2-((4-((3-aminopropyl)amino)butyl)amino)-1-hydroxy-2-oxoethyl)-, (S)-RefChem:905557DTXCID20160039N-((S)-((4-((3-aminopropyl)amino)butyl)carbamoyl)(hydroxy)methyl)-7-carbamimidamidoheptanamideUNII-57F9XM233R
Weitere Namen anzeigen
N-[(S)-1-Hydroxy-2-oxo-2-[[4-[(3-aminopropyl)amino]butyl]amino]ethyl]-7-guanidinoheptanamide7-Guanidino-N-[(S)-2-[[4-[(3-aminopropyl)amino]butyl]amino]-1-hydroxy-2-oxoethyl]heptanamideHeptanaMide, 7-[(aMinoiMinoMethyl)aMino]-N-[(1S)-2-[[4-[(3-aMinopropyl)aMino]butyl]aMino]-1-hydroxy-2-oxoethyl]-
N-[(1S)-2-[4-(3-aminopropylamino)butylamino]-1-hydroxy-2-oxoethyl]-7-(diaminomethylideneamino)heptanamide(S)-15-Deoxyspergualin15-DesoxyspergualinGUSPERIMUS, (S)-GUSPERIMUS (-)-FORMHeptanamide,7-[(aminoiminomethyl)amino]-N-[(1S)-2-[[4-[(3-aminopropyl)amino]butyl]amino]-1-hydroxy-2-oxoethyl]-orb1744973SCHEMBL8656104
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- -2
- Polarare Oberfläche (TPSA)
- 181 Ų
- H-Brücken-Donoren
- 7
- H-Brücken-Akzeptoren
- 6
- Frei drehbare Bindungen
- 17
- Schwere Atome
- 27
- Formalladung
- 0
- Komplexität
- 429
Experimentelle und physikochemische Eigenschaften
DrugsPharmaceuticals -> Listed in ZINC15
Solubility
H2O > 100 (mg/mL)
0.1N NaOH > 100 (mg/mL)
0.1N HCl > 100 (mg/mL)
95% EtOH > 100 (mg/mL)
MeOH > 100 (mg/mL)
DMSO > 100 (mg/mL)
Stability/Shelf LifeBulk: Samples stored at 25 °C for 3 months show 5-8% decomposition (HPLC).
Solution: As a 2 mg/mL solution in water at 25 °C, 15- deoxyspergualin is stable for at least 28 hrs under ordinary laboratory conditions (HPLC).
Chemie und Industrie
Pharmakologische Informationen
MeSH Pharmacological Classification
Chemical substances, produced by microorganisms, inhibiting or preventing the proliferation of neoplasms.
Substances which lower blood glucose levels.
Agents that suppress immune function by one of several mechanisms of action. Classical cytotoxic immunosuppressants act by inhibiting DNA synthesis. Others may act through activation of T-CELLS or by inhibiting the activation of HELPER CELLS. While immunosuppression has been brought about in the past primarily to prevent rejection of transplanted organs, new applications involving mediation of the effects of INTERLEUKINS and other CYTOKINES are emerging.
Drugs used to protect against ionizing radiation. They are usually of interest for use in radiation therapy but have been considered for other purposes, e.g. military.
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