methyl (E,2R,6R)-6-methyl-2-[(1R,2S)-2-methyl-1-oxidanyl-butyl]-9-[(2R)-2-methyl-6-oxidanyl-4-oxidanylidene-2,3-dihydropyran-5-yl]-9-oxidanylidene-non-3-enoate

Systemtic Name: methyl (E,2R,6R)-6-methyl-2-[(1R,2S)-2-methyl-1-oxidanyl-butyl]-9-[(2R)-2-methyl-6-oxidanyl-4-oxidanylidene-2,3-dihydropyran-5-yl]-9-oxidanylidene-non-3-enoate Openeye Name: methyl (E,2R,6R)-2-[(1R,2S)-1-hydroxy-2-methyl-butyl]-6-methyl-9-[(2R)-2-methyl-6-oxidanyl-4-oxidanylidene-2,3-dihydropyran-5-yl]-9-oxo-non-3-enoate CAS Name: (E,2R,6R)-2-[(1R,2S)-1-hydroxy-2-methylbutyl]-6-methyl-9-[(2R)-2-methyl-6-oxidanyl-4-oxidanylidene-2,3-dihydropyran-5-yl]-9-oxo-3-nonenoic acid methyl ester IUPAC Name: methyl (E,2R,6R)-2-[(1R,2S)-1-hydroxy-2-methylbutyl]-6-methyl-9-[(2R)-2-methyl-6-oxidanyl-4-oxidanylidene-2,3-dihydropyran-5-yl]-9-oxonon-3-enoate Traditional Name: (E,2R,6R)-2-[(1R,2S)-1-hydroxy-2-methyl-butyl]-9-keto-6-methyl-9-[(2R)-2-methyl-6-oxidanyl-4-oxidanylidene-2,3-dihydropyran-5-yl]non-3-enoic acid methyl ester Formula: C22H34O7 MolecularWeight: 419.478406

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(C=CCC(C)CCC(=O)C1=C(OC(CC1=O)C)O)C(=O)OC)O

Isomeric SMILES

CC[C@H](C)[C@H]([C@@H](/C=C/C[C@H](C)CCC(=O)C1=[13C]([18O][13C@@H](C[13C]1=[18O])C)[18OH])C(=O)OC)O

InChI

InChI=1S/C22H34O7/c1-6-14(3)20(25)16(21(26)28-5)9-7-8-13(2)10-11-17(23)19-18(24)12-15(4)29-22(19)27/h7,9,13-16,20,25,27H,6,8,10-12H2,1-5H3/b9-7+/t13-,14-,15+,16+,20+/m0/s1/i15+1,18+1,22+1,24+2,27+2,29+2