(2S)-2-methyl-4-[12-[(4S,6R)-6-[(2R,5R)-5-[(1S)-1-oxidanyltridecyl]oxolan-2-yl]-1,3-dioxan-4-yl]dodecyl]-2H-furan-5-one

Systemtic Name: (2S)-2-methyl-4-[12-[(4S,6R)-6-[(2R,5R)-5-[(1S)-1-oxidanyltridecyl]oxolan-2-yl]-1,3-dioxan-4-yl]dodecyl]-2H-furan-5-one Openeye Name: (2S)-4-[12-[(4S,6R)-6-[(2R,5R)-5-[(1S)-1-hydroxytridecyl]tetrahydrofuran-2-yl]-1,3-dioxan-4-yl]dodecyl]-2-methyl-2H-furan-5-one CAS Name: (2S)-4-[12-[(4S,6R)-6-[(2R,5R)-5-[(1S)-1-hydroxytridecyl]-2-oxolanyl]-1,3-dioxan-4-yl]dodecyl]-2-methyl-2H-furan-5-one IUPAC Name: (2S)-4-[12-[(4S,6R)-6-[(2R,5R)-5-[(1S)-1-hydroxytridecyl]oxolan-2-yl]-1,3-dioxan-4-yl]dodecyl]-2-methyl-2H-furan-5-one Traditional Name: (2S)-4-[12-[(4S,6R)-6-[(2R,5R)-5-[(1S)-1-hydroxytridecyl]tetrahydrofuran-2-yl]-1,3-dioxan-4-yl]dodecyl]-2-methyl-2H-furan-5-one Formula: C38H68O6 MolecularWeight: 620.94292

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(C1CCC(O1)C2CC(OCO2)CCCCCCCCCCCCC3=CC(OC3=O)C)O

Isomeric SMILES

CCCCCCCCCCCC[C@@H]([C@H]1CC[C@@H](O1)[C@H]2C[C@@H](OCO2)CCCCCCCCCCCCC3=C[C@@H](OC3=O)C)O

InChI

InChI=1S/C38H68O6/c1-3-4-5-6-7-8-13-16-19-22-25-34(39)35-26-27-36(44-35)37-29-33(41-30-42-37)24-21-18-15-12-10-9-11-14-17-20-23-32-28-31(2)43-38(32)40/h28,31,33-37,39H,3-27,29-30H2,1-2H3/t31-,33-,34-,35+,36+,37+/m0/s1