7-ethyl-5-icosyl-1,2,3-tris(oxidanyl)undecane-4,6-dione

Systemtic Name: 7-ethyl-5-icosyl-1,2,3-tris(oxidanyl)undecane-4,6-dione Openeye Name: 7-ethyl-1,2,3-trihydroxy-5-icosyl-undecane-4,6-dione CAS Name: 5-eicosyl-7-ethyl-1,2,3-trihydroxyundecane-4,6-dione IUPAC Name: 7-ethyl-1,2,3-trihydroxy-5-icosylundecane-4,6-dione Traditional Name: 5-arachyl-7-ethyl-1,2,3-trihydroxy-undecane-4,6-dione Formula: C33H64O5 MolecularWeight: 540.85826

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCC(C(=O)C(CC)CCCC)C(=O)C(C(CO)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCC(C(=O)C(CC)CCCC)C(=O)C(C(CO)O)O

InChI

InChI=1S/C33H64O5/c1-4-7-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-26-29(32(37)33(38)30(35)27-34)31(36)28(6-3)25-8-5-2/h28-30,33-35,38H,4-27H2,1-3H3