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Chemical Entities of Biological Interest Ontology
Last uploaded:
November 5, 2024
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| Preferred Name | valganciclovir | |
| Synonyms |
valganciclovir 2-[(2-amino-6-oxo-3,6-dihydro-9H-purin-9-yl)methoxy]-3-hydroxypropyl L-valinate |
|
| Definitions |
The L-valinyl ester of ganciclovir, into which it is rapidly converted by intestinal and hepatic esterases. It is a synthetic analogue of 2'-deoxyguanosine. |
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| ID |
http://purl.obolibrary.org/obo/CHEBI_63635 |
|
| charge |
0
|
|
| database_cross_reference |
DrugBank:DB01610 KEGG:D02495 Reaxys:14503833 Drug_Central:2801 CAS:175865-60-8 Wikipedia:Valganciclovir
|
|
| definition |
The L-valinyl ester of ganciclovir, into which it is rapidly converted by intestinal and hepatic esterases. It is a synthetic analogue of 2'-deoxyguanosine.
|
|
| formula |
C14H22N6O5
|
|
| has functional parent | ||
| has role | ||
| has_exact_synonym |
2-[(2-amino-6-oxo-3,6-dihydro-9H-purin-9-yl)methoxy]-3-hydroxypropyl L-valinate
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|
| has_obo_namespace |
chebi_ontology
|
|
| has_related_synonym |
valganciclovir
|
|
| id |
CHEBI:63635
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|
| in_subset | ||
| inchi |
InChI=1S/C14H22N6O5/c1-7(2)9(15)13(23)24-4-8(3-21)25-6-20-5-17-10-11(20)18-14(16)19-12(10)22/h5,7-9,21H,3-4,6,15H2,1-2H3,(H3,16,18,19,22)/t8?,9-/m0/s1
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|
| inchikey |
WPVFJKSGQUFQAP-GKAPJAKFSA-N
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|
| label |
valganciclovir
|
|
| mass |
354.36170
|
|
| monoisotopicmass |
354.16517
|
|
| notation |
CHEBI:63635
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|
| prefLabel |
valganciclovir
|
|
| smiles |
CC(C)[C@H](N)C(=O)OCC(CO)OCn1cnc2c1[nH]c(N)nc2=O
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| treeView | ||
| subClassOf |
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