(E)-2,3-bis(oxidanyl)-4-oxidanylidene-henicos-12-enoic acid

Systemtic Name: (E)-2,3-bis(oxidanyl)-4-oxidanylidene-henicos-12-enoic acid Openeye Name: (E)-2,3-dihydroxy-4-oxo-henicos-12-enoic acid CAS Name: (E)-2,3-dihydroxy-4-oxo-12-heneicosenoic acid IUPAC Name: (E)-2,3-dihydroxy-4-oxohenicos-12-enoic acid Traditional Name: (E)-2,3-dihydroxy-4-keto-heneicos-12-enoic acid Formula: C21H38O5 MolecularWeight: 370.52342

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)C(C(C(=O)O)O)O

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)C(C(C(=O)O)O)O

InChI

InChI=1S/C21H38O5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(22)19(23)20(24)21(25)26/h9-10,19-20,23-24H,2-8,11-17H2,1H3,(H,25,26)/b10-9+