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Biological and Environmental Research Ontology
Last uploaded:
December 23, 2022
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| Preferred Name | penciclovir | |
| Synonyms |
9-(4-hydroxy-3-hydroxymethylbut-1-yl)-guanine 9-[2-hydroxy-1-(hydroxymethyl)-ethoxymethyl]guanine 9-(4-hydroxy-3-(hydroxymethyl)butyl)guanine penciclovirum 9-[4-hydroxy-3-(hydroxymethyl)but-1-yl]guanine penciclovir PCV PE2 2-amino-9-[4-hydroxy-3-(hydroxymethyl)butyl]-1,9-dihydro-6H-purin-6-one |
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| Definitions |
A member of the class of 2-aminopurines that is guanine in which the hydrogen at position 9 is substituted by a 4-hydroxy-3-(hydroxymethyl)but-1-yl group. An antiviral drug, it is administered topically for treatment of herpes labialis. A prodrug, famciclovir, is used for oral administration. |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_7956 |
|
| alternative term |
9-(4-hydroxy-3-hydroxymethylbut-1-yl)-guanine 9-[2-hydroxy-1-(hydroxymethyl)-ethoxymethyl]guanine 9-(4-hydroxy-3-(hydroxymethyl)butyl)guanine penciclovirum 9-[4-hydroxy-3-(hydroxymethyl)but-1-yl]guanine penciclovir PCV PE2 2-amino-9-[4-hydroxy-3-(hydroxymethyl)butyl]-1,9-dihydro-6H-purin-6-one
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| bearer of | ||
| charge |
0
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| database_cross_reference |
LINCS:LSM-5587 Wikipedia:Penciclovir HMDB:HMDB0014444 Drug_Central:2079 KEGG:C07417 DrugBank:DB00299 KEGG:D05407 Patent:US5075445 PDBeChem:PE2 Reaxys:4501039 CAS:39809-25-1 PMID:3040998
|
|
| definition |
A member of the class of 2-aminopurines that is guanine in which the hydrogen at position 9 is substituted by a 4-hydroxy-3-(hydroxymethyl)but-1-yl group. An antiviral drug, it is administered topically for treatment of herpes labialis. A prodrug, famciclovir, is used for oral administration.
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|
| formula |
C10H15N5O3
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|
| has_alternative_id |
CHEBI:44870
|
|
| has_exact_synonym |
2-amino-9-[4-hydroxy-3-(hydroxymethyl)butyl]-1,9-dihydro-6H-purin-6-one
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| has_functional_parent | ||
| has_obo_namespace |
chebi_ontology
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| has_related_synonym |
9-(4-hydroxy-3-hydroxymethylbut-1-yl)-guanine 9-[2-hydroxy-1-(hydroxymethyl)-ethoxymethyl]guanine 9-(4-hydroxy-3-(hydroxymethyl)butyl)guanine penciclovirum 9-[4-hydroxy-3-(hydroxymethyl)but-1-yl]guanine penciclovir PCV PE2
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|
| id |
CHEBI:7956
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|
| in_subset | ||
| inchi |
InChI=1S/C10H15N5O3/c11-10-13-8-7(9(18)14-10)12-5-15(8)2-1-6(3-16)4-17/h5-6,16-17H,1-4H2,(H3,11,13,14,18)
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|
| inchikey |
JNTOCHDNEULJHD-UHFFFAOYSA-N
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|
| label |
penciclovir
|
|
| mass |
253.25780
|
|
| monoisotopicmass |
253.11749
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| notation |
CHEBI:7956
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| prefLabel |
penciclovir
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| RO_0000087 | ||
| smiles |
Nc1nc2n(CCC(CO)CO)cnc2c(=O)[nH]1
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| subClassOf |
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