4-methoxy-3-[[4-methoxy-6-[(1S)-1-oxidanylheptyl]-2-oxidanylidene-pyran-3-yl]methoxymethyl]-6-[(1S)-1-oxidanylheptyl]pyran-2-one

Systemtic Name: 4-methoxy-3-[[4-methoxy-6-[(1S)-1-oxidanylheptyl]-2-oxidanylidene-pyran-3-yl]methoxymethyl]-6-[(1S)-1-oxidanylheptyl]pyran-2-one Openeye Name: 6-[(1S)-1-hydroxyheptyl]-3-[[6-[(1S)-1-hydroxyheptyl]-4-methoxy-2-oxo-pyran-3-yl]methoxymethyl]-4-methoxy-pyran-2-one CAS Name: 6-[(1S)-1-hydroxyheptyl]-3-[[6-[(1S)-1-hydroxyheptyl]-4-methoxy-2-oxo-3-pyranyl]methoxymethyl]-4-methoxy-2-pyranone IUPAC Name: 6-[(1S)-1-hydroxyheptyl]-3-[[6-[(1S)-1-hydroxyheptyl]-4-methoxy-2-oxopyran-3-yl]methoxymethyl]-4-methoxypyran-2-one Traditional Name: 6-[(1S)-1-hydroxyheptyl]-3-[[6-[(1S)-1-hydroxyheptyl]-2-keto-4-methoxy-pyran-3-yl]methoxymethyl]-4-methoxy-pyran-2-one Formula: C28H42O9 MolecularWeight: 522.62768

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C1=CC(=C(C(=O)O1)COCC2=C(C=C(OC2=O)C(CCCCCC)O)OC)OC)O

Isomeric SMILES

CCCCCC[C@@H](C1=CC(=C(C(=O)O1)COCC2=C(C=C(OC2=O)[C@H](CCCCCC)O)OC)OC)O

InChI

InChI=1S/C28H42O9/c1-5-7-9-11-13-21(29)25-15-23(33-3)19(27(31)36-25)17-35-18-20-24(34-4)16-26(37-28(20)32)22(30)14-12-10-8-6-2/h15-16,21-22,29-30H,5-14,17-18H2,1-4H3/t21-,22-/m0/s1