entecavir hydrate

chemical compound

Wikidata entity: Q27126952

C₁₂H₁₇N₅O₄ (P274)



Quantities

P2067mass295.128054

P3780 active ingredient in ... Q29004884 (Baraclude) Baraclude
P233 canonical SMILES String C=C1C(CC(C1CO)O)N2C=NC3=C2NC(=NC3=O)N.O ???
P31 instance of ... Q113145171 (type of chemical entity) type of chemical entity
P2017 isomeric SMILES String O.NC1=NC2=C(N=CN2[C@H]3C[C@H](O)[C@@H](CO)C3=C)C(=O)N1 ???
P2175 medical condition treated ... Q147778 (liver cirrhosis) liver cirrhosis
P2175 medical condition treated ... Q6853 (hepatitis B) hepatitis B
P2175 medical condition treated ... Q55779876 (chronic hepatitis B) chronic hepatitis B
P1748 NCI Thesaurus ID String C65513 ???
P279 subclass of ... Q2689559 (nucleoside analogue) nucleoside analogue
P2868 subject has role ... Q421559 (reverse-transcriptase inhibitor) reverse-transcriptase inhibitor
P2868 subject has role ... Q40207875 (antiviral agent) antiviral agent

External Ids
P8072CAB ID146094
P231CAS Registry Number209216-23-9
P683ChEBI ID59902
P661ChemSpider ID10482312
P715DrugBank IDDBSALT001748
P8494DSSTOX compound identifierDTXCID001371561
P3117DSSTox substance IDDTXSID00943185
P232EC number606-668-5
P2566ECHA Substance Infocard ID100.116.642
P234InChIInChI=1S/C12H15N5O3.H2O/c1-5-6(3-18)8(19)2-7(5)17-4-14-9-10(17)15-12(13)16-11(9)20;/h4,6-8,18-19H,1-3H2,(H3,13,15,16,20);1H2/t6-,7-,8-;/m0./s1
P235InChIKeyYXPVEXCTPGULBZ-WQYNNSOESA-N
P665KEGG IDD04008
P11199Probes And Drugs IDPD011040
P662PubChem CID16052026
P662PubChem CID135526609
P3345RxNorm CUI306266
P2877SureChEMBL ID28647
P652UNII5968Y6H45M

Why not click here or view trends?

log id: 2183400