Substance
- Substance Name: sorbitan monooleate
- Formula: C24H44O6
- Molecular Weight: 428.6 g/mol
- Identifiers:
- casrn: 1338-43-8
- pubchemId: 9920342
- iupacname: [(2R)-2-[(2R,3R,4S)-3,4-dihydroxyoxolan-2-yl]-2-hydroxyethyl] (Z)-octadec-9-enoate
- inchi: InChI=1S/C24H44O6/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22(27)29-19-21(26)24-23(28)20(25)18-30-24/h9-10,20-21,23-26,28H,2-8,11-19H2,1H3/b10-9-/t20-,21+,23+,24+/m0/s1
- inchikey: NWGKJDSIEKMTRX-AAZCQSIUSA-N
- csmiles: CCCCCCCCC=CCCCCCCCC(=O)OCC(C1C(C(CO1)O)O)O
- ismiles: CCCCCCCC/C=C\CCCCCCCC(=O)OC[C@H]([C@@H]1[C@@H]([C@H](CO1)O)O)O
- wikidataId: Q2303156
- chemspiderId: 8095979
- dsstoxcmpId: DTXCID807397
- chemblId: CHEMBL1894187
- ecnumber: 215-665-4
sorbitan monooleate
Systems and Datasets
- sorbitan monooleate + water + rofecoxib (Datasets: 1)
- Dataset 5 in paper 10.1021/je050276s (Dataseries: 3, Datapoints: 15, Quantity: Mass concentration)