Ketotrexate structure, CAS 52196-22-2

Ketotrexate

CAS Number52196-22-2

Synonyms5-methyltetrahydrohomofolicacid

Molecular FormulaC21H27N7O6

Molecular Weight473.48200

Purity98%

Density1.58g/cm3

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Cat. No.: 2A-9011104 Purity: 98%
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Quality Control of [ 52196-22-2 ] Purity: 98% SDS Specification MoL

Chemical & Physical Properties
CAS Number52196-22-2
Catalog No.2A-9011104
Chinese Name甲满蝶呤
Synonyms5-methyltetrahydrohomofolicacid
Molecular FormulaC21H27N7O6
Molecular Weight473.48200
Purity98
Density1.58g/cm3
SMILES[Na+].[Na+].CN1C(CCNc2ccc(cc2)C(=O)N[C@@H](CCC([O-])=O)C([O-])=O)CNC3=C1C(=O)N=C(N)N3
InChIInChI=1S/C21H27N7O6.2Na/c1-28-13(10-24-17-16(28)19(32)27-21(22)26-17)8-9-23-12-4-2-11(3-5-12)18(31)25-14(20(33)34)6-7-15(29)30;;/h2-5,13-14,23H,6-10H2,1H3,(H,25,31)(H,29,30)(H,33,34)(H4,22,24,26,27,32);;/q;2*+1/p-2/t13?,14-;;/m0../s1
InChI KeyInChIKey=PASPSZYIMAFFFK-HNYZGNTBSA-L
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