Chemical Component Summary

Name(S)-4-BROMO-3-HYDROXY-3-METHYLBUTYL DIPHOSPHATE
Identifiers[(3S)-4-bromo-3-hydroxy-3-methyl-butyl] phosphono hydrogen phosphate
FormulaC5 H13 Br O8 P2
Molecular Weight343.003
TypeNON-POLYMER
Isomeric SMILESC[C@](CCO[P@@](=O)(O)OP(=O)(O)O)(CBr)O
InChIInChI=1S/C5H13BrO8P2/c1-5(7,4-6)2-3-13-16(11,12)14-15(8,9)10/h7H,2-4H2,1H3,(H,11,12)(H2,8,9,10)/t5-/m0/s1
InChIKeyYKAYCWPQDPILSA-YFKPBYRVSA-N

Chemical Details

Formal Charge0
Atom Count29
Chiral Atom Count2
Bond Count28
Aromatic Bond Count0

Drug Info: DrugBank

DrugBank IDDB02480 
Name(S)-4-bromo-3-hydroxy-3-methylbutyl diphosphate
Groups experimental
Synonyms(S)-4-bromo-3-hydroxy-3-methylbutyl diphosphate

Drug Targets

NameTarget SequencePharmacological ActionActions
Isopentenyl-diphosphate Delta-isomeraseMQTEHVILLNAQGVPTGTLEKYAAHTADTRLHLAFSSWLFNAKGQLLVTR...unknown
Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682

Related Resource References

Resource NameReference
PubChem 17754158
ChEMBL CHEMBL185586