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CHEBI:235413 - RHPS4 methosulfate

ChEBI IDCHEBI:235413
ChEBI NameRHPS4 methosulfate
Stars
SubmitterFlyBase
DownloadsMolfile
FormulaC22H17F2N2.CH3O4S
Net Charge0
Average Mass458.486
Monoisotopic Mass458.11118
SMILESCOS(=O)(=O)[O-].Cc1cc2c3c([n+](C)c4ccc(F)cc4c3c1)-c1cc(F)ccc1N2C
InChIInChI=1S/C22H17F2N2.CH4O4S/c1-12-8-16-15-10-13(23)4-6-18(15)26(3)22-17-11-14(24)5-7-19(17)25(2)20(9-12)21(16)22;1-5-6(2,3)4/h4-11H,1-3H3;1H3,(H,2,3,4)/q+1;/p-1
InChIKeyVRWGYMXWYZBBGF-UHFFFAOYSA-M
Roles Classification
Biological Role:
EC 2.7.7.49 (RNA-directed DNA polymerase) inhibitor  A DNA polymerase inhibitor that interferes with the activity of reverse transcriptase, EC 2.7.7.49, a viral DNA polymerase enzyme that retroviruses need in order to reproduce.
ChEBI Ontology
Outgoing Relation(s)
RHPS4 methosulfate (CHEBI:235413) has role EC 2.7.7.49 (RNA-directed DNA polymerase) inhibitor (CHEBI:59897)
RHPS4 methosulfate (CHEBI:235413) is a organic molecular entity (CHEBI:50860)
IUPAC Name 
4,16-difluoro-8,11,20-trimethyl-8-aza-20-azoniapentacyclo[11.7.1.02,7.09,21.014,19]henicosa-1(20),2(7),3,5,9,11,13(21),14(19),15,17-decaene;methyl sulfate
Citations