Basic information
- CAS
17146-80-4- Standard SMILES
Nc1nc(N)c2nc(CNc3ccc(C(=O)NC(CCC(=O)[O-])C(=O)[O-])cc3)cnc2n1.[Na+].[Na+]- InChIKey
QIJUDBRPDXKSEF-LTCKWSDVSA-N- Molecular formula
- C19H18N8Na2O5
- Average molar mass
- 484.4 g/mol
Names & identifiers
- Preferred name
- Aminopteroylglutamate sodium
- IUPAC
- disodium;2-[[4-[(2,4-diaminopteridin-6-yl)methylamino]benzoyl]amino]pentanedioate
- English name
- AminopterinSodium
- Molecular formula
- C19H21N8NaO5
- Molecular weight
- 464.42
Names & synonyms
7007-85-4disodium;2-[[4-[(2,4-diaminopteridin-6-yl)methylamino]benzoyl]amino]pentanedioateNatrium 4-aminfolatAminopteroylglutamate sodiumSodium aminopteroylglytamateSodium salt of N-(p-(((2,4-diamino-6-pteridinyl)methyl)amino)benzoyl)glutamic acidSCHEMBL2504080DTXSID70937990N-(4-(((2,4-Diamino-6-pteridinyl)methyl)amino)benzoyl)glutaminsaeure dinatriumsalt17146-80-4Disodium 2-(4-{[(4-amino-2-imino-2,3-dihydropteridin-6-yl)methyl]amino}benzamido)pentanedioateGlutamic acid, N-(p-(((2,4-diamino-6-pteridinyl)methyl)amino)benzoyl)-, monosodium salt, L-
Show more names
AminopterinSodiumAminopterina sodicaAminopterine sodiqueAminopterinum natricum2-[[4-[(2,4-diaminopteridin-6-yl)methylamino]benzoyl]amino]pentanedioate
Database identifiers
- CAS
17146-80-4、7007-85-4- PubChem CID
- 24194
- DTXSID
DTXSID70937990
Properties
Computed structural properties
- Topological polar surface area
- 225 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 12
- Rotatable bonds
- 7
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 663
Physicochemical properties
- FDA UNII
- 1 QI13O9 · FZU1QI13O9
Chemistry & industry
Suppliers1 total
Lanospharma Laboratories Co.,Ltd13440048448 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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