{"ymdb_id":"YMDB01783","created_at":"2011-08-31T03:44:47.000Z","updated_at":"2016-09-08T18:37:07.000Z","name":"Shikimate 3-phosphate","cas":null,"state":null,"melting_point":null,"description":"3-Phosphoshikimic acid is an intermediate in the chorismate biosynthesis pathway also called shikimate pathway. This pathway occurs in plants and microorganisms. Chorismate is an important intermediate that leads to the biosynthesis of several essential metabolites, including the aromatic amino acids L-phenylalanine, L-tyrosine and L-tryptophan, vitamins E and K, ubiquinone and certain siderophore. [Biocyc ARO-PWY]","experimental_water_solubility":null,"experimental_logp_hydrophobicity":null,"location":null,"synthesis_reference":null,"chebi_id":"17052","hmdb_id":null,"kegg_id":"C03175","pubchem_id":"1095","cs_id":"23096204","foodb_id":null,"wikipedia_link":null,"biocyc_id":null,"iupac":"(3R,4S,5R)-4,5-dihydroxy-3-(phosphonooxy)cyclohex-1-ene-1-carboxylic acid","traditional_iupac":"3-phosphoshikimic acid","logp":"-1.7636401083333335","pka":"4.1018283495734575","alogps_solubility":"2.10e+01 g/l","alogps_logp":"-2.07","alogps_logs":"-1.08","acceptor_count":"7","donor_count":"5","rotatable_bond_count":"3","polar_surface_area":"144.52","refractivity":"49.833200000000005","polarizability":"20.455959192130013","formal_charge":"0","physiological_charge":"-3","pka_strongest_basic":"-3.225778459939349","pka_strongest_acidic":"1.3157644234401227","bioavailability":"1","number_of_rings":"1","rule_of_five":"1","ghose_filter":"0","veber_rule":"0","mddr_like_rule":"0","synonyms":["4,5-dihydroxy-3-phosphonooxycyclohexene-1-carboxylic acid","AC1L1APQ","Shikimate 3-phosphate","Shikimate 5-phosphate"],"pathways":[],"growth_conditions":[],"references":[{"pubmed_id":19889834,"citation":"Boer, V. M., Crutchfield, C. A., Bradley, P. H., Botstein, D., Rabinowitz, J. D. (2010). \"Growth-limiting intracellular metabolites in yeast growing under diverse nutrient limitations.\" Mol Biol Cell 21:198-211."}],"proteins":[]}