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English
phototrexate
chemical compound; photoswitchable dihydrofolate reductase inhibitor
Phototrexate
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
1 reference
PubMed ID
30346152
has use
drug
1 reference
PubMed ID
30346152
mass
437.4088
dalton
1 reference
PubMed ID
30346152
chemical formula
C₂₀H₁₉N₇O₅
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
NC1=NC(=C2C=C(C=CC2=N1)N=NC3=CC=C(C=C3)C(=O)NC(CCC(O)=O)C(O)=O)N
0 references
described by source
Photoswitchable Antimetabolite for Targeted Photoactivated Chemotherapy
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Journal of the American Chemical Society
volume
140
issue
46
page(s)
15764–15773
publication date
2018
DOI
10.1021/JACS.8B08249
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subject has role
antimetabolites
1 reference
PubMed ID
30346152
antineoplastic
1 reference
PubMed ID
30346152
Photoswitch
1 reference
PubMed ID
30346152
antineoplastic antimetabolite
1 reference
PubMed ID
30346152
Identifiers
InChI
InChI=1S/C20H19N7O5/c21-17-13-9-12(5-6-14(13)24-20(22)25-17)27-26-11-3-1-10(2-4-11)18(30)23-15(19(31)32)7-8-16(28)29/h1-6,9,15H,7-8H2,(H,23,30)(H,28,29)(H,31,32)(H4,21,22,24,25)
1 reference
based on heuristic
inferred from SMILES
InChIKey
IODLJULYGHWOLC-UHFFFAOYSA-N
1 reference
based on heuristic
inferred from InChI
CAS Registry Number
2268033-83-4
0 references
2268033-82-3
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Google Knowledge Graph ID
/g/11h75_f65_
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enwiki
Phototrexate
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