(E)-2-oxidanyloctadec-9-enoate; propane-1,2,3-triol

Systemtic Name: (E)-2-oxidanyloctadec-9-enoate; propane-1,2,3-triol Openeye Name: glycerol; (E)-2-hydroxyoctadec-9-enoate CAS Name: (E)-2-hydroxy-9-octadecenoate; propane-1,2,3-triol IUPAC Name: (E)-2-hydroxyoctadec-9-enoate; propane-1,2,3-triol Traditional Name: glycerol; (E)-2-hydroxyoctadec-9-enoate Formula: C21H41O6- MolecularWeight: 389.54664

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCC(C(=O)[O-])O.C(C(CO)O)O

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCC(C(=O)[O-])O.C(C(CO)O)O

InChI

InChI=1S/C18H34O3.C3H8O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(19)18(20)21;4-1-3(6)2-5/h9-10,17,19H,2-8,11-16H2,1H3,(H,20,21);3-6H,1-2H2/p-1/b10-9+;