CAS
52196-11-9 Purity
96%
52196-11-9 Purity
96%
![3-Cyclopentene-1-carboxylicacid,1-[[(1,1-dimethylethoxy)carbonyl]amino]-,1,1-dimethylethyl ester](https://resource.alfa-chemistry.com/structure/521964-59-0.gif)
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Ketotrexate
CAS
52196-22-2
Catalog Number
ACM52196222
Category
Other Products
Molecular Weight
473.48
Molecular Formula
C21H27N7O6
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Specification
Synonyms
5-methyltetrahydrohomofolicacid;KETOTREXATE;N-[4-[[2-(2-Amino-1,4,5,6,7,8-hexahydro-5-methyl-4-oxopteridin-6-yl)ethyl]amino]benzoyl]-L-glutamic acid
IUPAC Name
2-[[4-[2-(2-amino-5-methyl-4-oxo-1,6,7,8-tetrahydropteridin-6-yl)ethylamino]benzoyl]amino]pentanedioic acid
Canonical SMILES
CN1C(CNC2=C1C(=O)N=C(N2)N)CCNC3=CC=C(C=C3)C(=O)NC(CCC(=O)O)C(=O)O
InChI Key
KCPBTDJBDDCNQE-UHFFFAOYSA-N
Density
1.58g/cm³
Exact Mass
473.20200
H-Bond Acceptor
9
H-Bond Donor
7
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521964-54-5 Purity
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