Substance
- Substance Name: (-)-shikimic acid
- Formula: C7H10O5
- Molecular Weight: 174.15 g/mol
- Identifiers:
- inchi: InChI=1S/C7H10O5/c8-4-1-3(7(11)12)2-5(9)6(4)10/h1,4-6,8-10H,2H2,(H,11,12)/t4-,5-,6-/m1/s1
- inchikey: JXOHGGNKMLTUBP-HSUXUTPPSA-N
- casrn: 138-59-0
- csmiles: C1C(C(C(C=C1C(=O)O)O)O)O
- ismiles: C1[C@H]([C@@H]([C@@H](C=C1C(=O)O)O)O)O
- pubchemId: 8742
- iupacname: (3R,4S,5R)-3,4,5-trihydroxycyclohexene-1-carboxylic acid
- wikidataId: Q410830
- chemspiderId: 8412
- dsstoxcmpId: DTXCID2012039
- chemblId: CHEMBL290345
- ecnumber: 205-334-2
(-)-shikimic acid
Systems and Datasets
- (-)-shikimic acid (Datasets: 1)
- Dataset 1 in paper 10.1016/j.jct.2015.04.009 (Dataseries: 1, Datapoints: 1, Quantity: Normal melting temperature)
- (-)-shikimic acid + water (Datasets: 1)
- Dataset 2 in paper 10.1016/j.jct.2015.04.009 (Dataseries: 1, Datapoints: 12, Quantity: Mole fraction)
- ethanol + (-)-shikimic acid (Datasets: 1)
- Dataset 3 in paper 10.1016/j.jct.2015.04.009 (Dataseries: 1, Datapoints: 11, Quantity: Mole fraction)
- propan-1-ol + (-)-shikimic acid (Datasets: 1)
- Dataset 4 in paper 10.1016/j.jct.2015.04.009 (Dataseries: 1, Datapoints: 12, Quantity: Mole fraction)
- propan-2-ol + (-)-shikimic acid (Datasets: 1)
- Dataset 5 in paper 10.1016/j.jct.2015.04.009 (Dataseries: 1, Datapoints: 11, Quantity: Mole fraction)
- pentan-1-ol + (-)-shikimic acid (Datasets: 1)
- Dataset 6 in paper 10.1016/j.jct.2015.04.009 (Dataseries: 1, Datapoints: 10, Quantity: Mole fraction)
- (-)-shikimic acid + heptane (Datasets: 1)
- Dataset 7 in paper 10.1016/j.jct.2015.04.009 (Dataseries: 1, Datapoints: 8, Quantity: Mole fraction)
- ethanol + (-)-shikimic acid + water (Datasets: 1)
- Dataset 8 in paper 10.1016/j.jct.2015.04.009 (Dataseries: 5, Datapoints: 58, Quantity: Mole fraction)