(E)-13-(hydroxymethyl)-13,14-bis(oxidanyl)dotriacont-23-ene-12,15-dione

Systemtic Name: (E)-13-(hydroxymethyl)-13,14-bis(oxidanyl)dotriacont-23-ene-12,15-dione Openeye Name: (E)-13,14-dihydroxy-13-(hydroxymethyl)dotriacont-23-ene-12,15-dione CAS Name: (E)-13,14-dihydroxy-13-(hydroxymethyl)-23-dotriacontene-12,15-dione IUPAC Name: (E)-13,14-dihydroxy-13-(hydroxymethyl)dotriacont-23-ene-12,15-dione Traditional Name: (E)-13,14-dihydroxy-13-methylol-dotriacont-23-ene-12,15-dione Formula: C33H62O5 MolecularWeight: 538.84238

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)C(CO)(C(C(=O)CCCCCCCC=CCCCCCCCC)O)O

Isomeric SMILES

CCCCCCCCCCCC(=O)C(CO)(C(C(=O)CCCCCCC/C=C/CCCCCCCC)O)O

InChI

InChI=1S/C33H62O5/c1-3-5-7-9-11-13-14-15-16-17-18-20-21-23-25-27-30(35)32(37)33(38,29-34)31(36)28-26-24-22-19-12-10-8-6-4-2/h15-16,32,34,37-38H,3-14,17-29H2,1-2H3/b16-15+