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Chemical Entities of Biological Interest Ontology
| Preferred Name | lamivudine | |
| Synonyms |
3'-Thia-2',3'-dideoxycytidine Epivir (-)-2'-Deoxy-3'-thiacytidine beta-L-2',3'-Dideoxy-3'-thiacytidine beta-L-3'-Thia-2',3'-dideoxycytidine 2',3'-Dideoxy-3'-thiacytidine (-)-1-((2R,5S)-2-(Hydroxymethyl)-1,3-oxathiolan-5-yl)cytosine lamivudine 3TC Lamivudine 4-amino-1-[(2R,5S)-2-(hydroxymethyl)-1,3-oxathiolan-5-yl]pyrimidin-2(1H)-one |
|
| Definitions |
A monothioacetal that consists of cytosine having a (2R,5S)-2-(hydroxymethyl)-1,3-oxathiolan-5-yl moiety attached at position 1. An inhibitor of HIV-1 reverse transcriptase, it is used as an antiviral in the treatment of AIDS and hepatitis B. |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_63577 |
|
| charge |
0
|
|
| database_cross_reference |
PMID:21721935 PMID:21465499 PMID:12135009 PMID:22231575 KEGG:C07065 PMID:22085635 PMID:28166217 PMID:22211086 PMID:22222724 PMID:22233654 PMID:19783232 PMID:25017682 KEGG:D00353 PMID:22078148 PMID:21851334 Patent:WO9117159 PMID:22226087 Reaxys:5480511 Drug_Central:1539 PMID:22097898 Wikipedia:Lamivudine PDBeChem:3TC CAS:134678-17-4 PMID:22001270 LINCS:LSM-5215 DrugBank:DB00709 PMID:22028068 PMID:29438107 PMID:22170540 PMID:22098177
|
|
| definition |
A monothioacetal that consists of cytosine having a (2R,5S)-2-(hydroxymethyl)-1,3-oxathiolan-5-yl moiety attached at position 1. An inhibitor of HIV-1 reverse transcriptase, it is used as an antiviral in the treatment of AIDS and hepatitis B.
|
|
| formula |
C8H11N3O3S
|
|
| has functional parent | ||
| has role |
http://purl.obolibrary.org/obo/CHEBI_53756 http://purl.obolibrary.org/obo/CHEBI_50904 http://purl.obolibrary.org/obo/CHEBI_59897 http://purl.obolibrary.org/obo/CHEBI_36044 |
|
| has_alternative_id |
CHEBI:6366
|
|
| has_exact_synonym |
Lamivudine 4-amino-1-[(2R,5S)-2-(hydroxymethyl)-1,3-oxathiolan-5-yl]pyrimidin-2(1H)-one
|
|
| has_obo_namespace |
chebi_ontology
|
|
| has_related_synonym |
3'-Thia-2',3'-dideoxycytidine Epivir (-)-2'-Deoxy-3'-thiacytidine beta-L-2',3'-Dideoxy-3'-thiacytidine beta-L-3'-Thia-2',3'-dideoxycytidine 2',3'-Dideoxy-3'-thiacytidine (-)-1-((2R,5S)-2-(Hydroxymethyl)-1,3-oxathiolan-5-yl)cytosine lamivudine 3TC
|
|
| id |
CHEBI:63577
|
|
| in_subset | ||
| inchi |
InChI=1S/C8H11N3O3S/c9-5-1-2-11(8(13)10-5)6-4-15-7(3-12)14-6/h1-2,6-7,12H,3-4H2,(H2,9,10,13)/t6-,7+/m0/s1
|
|
| inchikey |
JTEGQNOMFQHVDC-NKWVEPMBSA-N
|
|
| label |
lamivudine
|
|
| mass |
229.25600
|
|
| monoisotopicmass |
229.05211
|
|
| notation |
CHEBI:63577
|
|
| prefLabel |
lamivudine
|
|
| smiles |
Nc1ccn([C@@H]2CS[C@H](CO)O2)c(=O)n1
|
|
| treeView |
http://purl.obolibrary.org/obo/CHEBI_59793 http://purl.obolibrary.org/obo/CHEBI_38104 |
|
| subClassOf |
http://purl.obolibrary.org/obo/CHEBI_59793 http://purl.obolibrary.org/obo/CHEBI_38104 |
| Delete | Subject | Author | Type | Created |
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