Search Result : Detailed Informations

Low Mol Weight Allergen Name CAS# CID
Sorbitani oleas / sorbitan monooleate 1338-43-8 6433271

Structure Other Information
Canonical SMILES CCCCCCCCC=CCCCCCCCC(=O)OCC(C1C(C(CO1)O)O)O
Iso SMILES CCCCCCCC/C=CCCCCCCCC(=O)OCC([C@@H]1[C@H]([C@@H](CO1)O)O)O
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-/m1/s1
InChI Key NWGKJDSIEKMTRX-NZAQQJATSA-N
Formula C24H44O6
Mol Weight 428.603
XlogP3 6
Charge 0

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Synonyms Information
CAS Name (Z)-9-octadecenoic acid [2-[(2R,3S,4R)-3,4-dihydroxy-2-oxolanyl]-2-hydroxyethyl] ester
IUPAC Name [2-[(2R,3S,4R)-3,4-dihydroxytetrahydrofuran-2-yl]-2-hydroxy-ethyl] (Z)-octadec-9-enoate
Openeye Name [2-[(2R,3S,4R)-3,4-dihydroxyoxolan-2-yl]-2-hydroxyethyl] (Z)-octadec-9-enoate
Systematic Name [2-[(2R,3S,4R)-3,4-bis(oxidanyl)oxolan-2-yl]-2-oxidanyl-ethyl] (Z)-octadec-9-enoate
Tratitional Name [2-[(2R,3S,4R)-3,4-bis(oxidanyl)oxolan-2-yl]-2-oxidanyl-ethyl] (Z)-octadec-9-enoate