4'-Deoxy-20',20'-difluoro-C'-norvincaleukoblastine
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Grundinformationen
- CAS
162652-95-1- Standard-SMILES
CC[C@]12C=CCN3CC[C@@]4(c5cc([C@@]6(C(=O)OC)C[C@@H]7C[C@@H](C(C)(F)F)CN(Cc8c6[nH]c6ccccc86)C7)c(OC)cc5N(C)[C@H]4[C@@](O)(C(=O)OC)[C@@H]1OC(C)=O)[C@@H]32- InChIKey
NMDYYWFGPIMTKO-KLCPSUAYSA-N- Summenformel
- C45H54F2N4O8
- Durchschnittliche Molmasse
- 816,943 g/mol
- Monoisotopische Masse
- 816,39097113
Namen und Bezeichner
- Bevorzugter Name
- 4'-Deoxy-20',20'-difluoro-C'-norvincaleukoblastine
- IUPAC
- Methyl 4beta-(acetyloxy)-15-[(4R,6S,8S)-4-(1,1-difluoroethyl)-8-(methoxycarbonyl)-1,3,4,5,6,7,8,9-octahydro-2,6-methanoazecino[4,3-b]indol-8-yl]-3beta-hydroxy-16-methoxy-1-methyl-2beta,5alpha,12beta,19alpha-6,7-didehydroaspidospermidine-3alpha-carboxylate
- Englischer Name
- Vinflunine
- Summenformel
- C45H54F2N4O8
- Molmasse
- 816.94
Namen und Synonyme
Vinflunine TartrateVINFLUNINEvinflunine（97%）Vinflunine (F12158)Vinflunine USP/EP/BPVinflunine 162652-95-120',20'-Difluoro-3',4'-dihydrovinorelbine4'-Deoxy-20',20'-difluoro-8'-norvincaleukoblastine4'-Deoxy-20',20'-difluoro-5'-norvincaleukoblastineAspidospermidine-3-carboxylicacid,4-(acetyloxy)-6,7-didehydro-15-[(2R,4R,6S,8S)-4-(1,1-difluoroethyl)-1,3,4,5,6,7,8,9-octahydro-8-(methoxycarbonyl)-2,6-methano-2H-azecino[4,3-b]indol-8-yl]-3-hydroxy-1
Datenbank-Bezeichner
- CAS
162652-95-1- PubChem CID
- 10629256
- DTXSID
DTXSID30936722- ChEMBL
CHEMBL2110725- ChEBI
CHEBI:90241- UNII
- 5BF646324K
Eigenschaften
Physikochemische Eigenschaften
- Dichte
- 1.39 · 1.39±0.1 g/cm3(Predicted)
- pka
- 11.36 · 11.36±0.60(Predicted)
- CAS Datenbank
- 162652 · 162652-95-1(CAS DataBase Reference)
Chemie und Industrie
Anwendungen
BeschreibungVinflunine (also referred to as PM391) is a semisynthetic analog of the natural vinca alkaloids vinblastine and vincristine that was approved by the European Medicines Agency (EMEA) in 2009 for the treatment of adult patients with advanced or metastatic transitional cell carcinoma of the urothelial tract after failure of a prior platinum-containing regimen. Vinflunine is synthesized from anhydrovinblastine in a superacid media (HF-SbF5) and in the presence of a chlorinated solvent like CHCl3 or CCl4.
Vor- und nachgelagerte Produkte
Vorgelagerte Rohstoffe
Ergänzende Hinweise
DefinitionChEBI: An organic heteropentacyclic compound and an organic heterotetracyclic compound that is vinorelbine in which the tetrahydropyridine moiety of the heterotetracyclic part of the molecule has been redced to the corresponding piperidine, and in which the ethy group attached to this ring has been replaced by a 1,1-difluoroethyl group.
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