Lometrexol Sodium
Grundinformationen
- CAS
120408-07-3- Standard-SMILES
Nc1nc2c(c(=O)[nH]1)C[C@@H](CCc1ccc(C(=O)N[C@@H](CCC(=O)[O-])C(=O)[O-])cc1)CN2.[Na+].[Na+]- InChIKey
SVJSWELRJWVPQD-KJWOGLQMSA-L- Summenformel
- C21H23N5Na2O6
- Durchschnittliche Molmasse
- 487,4 g/mol
- Monoisotopische Masse
- 487,14437203
Überblick
Lometrexol Sodium is the sodium salt form of lometrexol, a folate analogue antimetabolite with antineoplastic activity. As the stereoisomer of 5,10-dideazatetrahydrofolate, lometrexol selectively inhibits glycinamide ribonucleotide formyltransferase (GARFT), the enzyme that catalyzes the first step in the de novo purine biosynthetic pathway, thereby inhibiting DNA synthesis and leading to an inhibition of tumor cell proliferation. The agent has been shown to be active against tumors that are resistant to the folate antagonist methotrexate, but causes severe, dose-limiting toxicities.
Namen und Bezeichner
- Bevorzugter Name
- Lometrexol Sodium
- IUPAC
- disodium;(2S)-2-[[4-[2-[(6R)-2-amino-4-oxo-5,6,7,8-tetrahydro-3H-pyrido[2,3-d]pyrimidin-6-yl]ethyl]benzoyl]amino]pentanedioate
- Englischer Name
- L-Glutamic acid,N-[4-[2-[(6R)-2-amino-3,4,5,6,7,8-hexahydro-4-oxopyrido[2,3-d]pyrimidin-6-yl]ethyl]benzoyl]-,sodium salt (1:2)
- Summenformel
- C21H26N5NaO6
- Molmasse
- 467.46
Namen und Synonyme
Lometrexol sodium120408-07-3LY264618 disodiumLY 264618 disodiumLometrexol Sodium [USAN]UNII-US81N1145TLY-264618 DISODIUMUS81N1145TLometrexol sodium (USAN)NSC-722969LOMETREXOL SODIUM [WHO-DD]NSC 722969
Weitere Namen anzeigen
L-Glutamic acid,N-[4-[2-[(6R)-2-amino-3,4,5,6,7,8-hexahydro-4-oxopyrido[2,3-d]pyrimidin-6-yl]ethyl]benzoyl]-,sodium salt (1:2)
Disodium N-(p-(2-((R)-2-amino-3,4,5,6,7,8-hexahydro-4-oxopyrido(2,3-d)pyrimidin-6-yl)ethyl)benzoyl)-L-glutamateL-Glutamic acid, N-(4-(2-(2-amino-1,4,5,6,7,8-hexahydro-4-oxopyrido(2,3-d)pyrimidin-6-yl)ethyl)benzoyl)-, disodium salt, (R)-L-Glutamic acid, N-(4-(2-(2-amino-3,4,5,6,7,8-hexahydro-4-oxopyrido(2,3-d)pyrimidin-6-yl)ethyl)benzoyl)-, disodium salt, (R)-L-Glutamic acid, N-(4-(2-((6R)-2-amino-1,4,5,6,7,8-hexahydro-4-oxopyrido(2,3-d)pyrimidin-6-yl)ethyl)benzoyl)-, disodium saltRefChem:153989Lometrexol disodiumdisodium;(2S)-2-[[4-[2-[(6R)-2-amino-4-oxo-5,6,7,8-tetrahydro-3H-pyrido[2,3-d]pyrimidin-6-yl]ethyl]benzoyl]amino]pentanedioateSCHEMBL3912
Datenbank-Bezeichner
- CAS
120408-07-3- PubChem CID
- 135508134
- ChEMBL
CHEMBL2104666- UNII
- US81N1145T
Eigenschaften
Berechnete Struktureigenschaften
- Polarare Oberfläche (TPSA)
- 189 Ų
- H-Brücken-Donoren
- 4
- H-Brücken-Akzeptoren
- 8
- Frei drehbare Bindungen
- 7
- Schwere Atome
- 34
- Formalladung
- 0
- Komplexität
- 820
Physikochemische Eigenschaften
- storage temp.
- -20 °C · Store at -20°C
- Löslichkeit
- 0 · DMSO:0.0(Max Conc. mg/mL);0.0(Max Conc. mM)
- Aggregatzustand
- Solid
- Farbe
- White to light yellow
Chemie und Industrie
Anwendungen
VerwendenAntineo plastic.
Anbieter2 Anbieter
Aladdin Scientific[email protected]
BOC Sciences1-631-485-4226; 16314854226 · [email protected]
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