4-[(Z,13R,14R)-13,14-bis(oxidanyl)triacont-17-enyl]-2-methyl-2H-furan-5-one

Systemtic Name: 4-[(Z,13R,14R)-13,14-bis(oxidanyl)triacont-17-enyl]-2-methyl-2H-furan-5-one Openeye Name: 4-[(Z,13R,14R)-13,14-dihydroxytriacont-17-enyl]-2-methyl-2H-furan-5-one CAS Name: 4-[(Z,13R,14R)-13,14-dihydroxytriacont-17-enyl]-2-methyl-2H-furan-5-one IUPAC Name: 4-[(Z,13R,14R)-13,14-dihydroxytriacont-17-enyl]-2-methyl-2H-furan-5-one Traditional Name: 4-[(Z,13R,14R)-13,14-dihydroxytriacont-17-enyl]-2-methyl-2H-furan-5-one Formula: C35H64O4 MolecularWeight: 548.88026

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC=CCCC(C(CCCCCCCCCCCCC1=CC(OC1=O)C)O)O

Isomeric SMILES

CCCCCCCCCCCC/C=C\CC[C@H]([C@@H](CCCCCCCCCCCCC1=CC(OC1=O)C)O)O

InChI

InChI=1S/C35H64O4/c1-3-4-5-6-7-8-9-10-11-12-16-19-22-25-28-33(36)34(37)29-26-23-20-17-14-13-15-18-21-24-27-32-30-31(2)39-35(32)38/h19,22,30-31,33-34,36-37H,3-18,20-21,23-29H2,1-2H3/b22-19-/t31?,33-,34-/m1/s1