(7R,10S)-7-methyl-10-[(2R)-1-phenylsulfanyl-4-[(1S,2R,3R,4R)-1,2,4-trimethyl-7-oxabicyclo[2.2.1]heptan-3-yl]butan-2-yl]-1,4-dioxaspiro[4.5]decane

Systemtic Name: (7R,10S)-7-methyl-10-[(2R)-1-phenylsulfanyl-4-[(1S,2R,3R,4R)-1,2,4-trimethyl-7-oxabicyclo[2.2.1]heptan-3-yl]butan-2-yl]-1,4-dioxaspiro[4.5]decane Openeye Name: (7R,10S)-7-methyl-10-[(1R)-1-(phenylsulfanylmethyl)-3-[(1S,2R,3R,4R)-1,2,4-trimethyl-7-oxabicyclo[2.2.1]heptan-3-yl]propyl]-1,4-dioxaspiro[4.5]decane CAS Name: (7R,10S)-7-methyl-10-[(2R)-1-(phenylthio)-4-[(1S,2R,3R,4R)-1,2,4-trimethyl-7-oxabicyclo[2.2.1]heptan-3-yl]butan-2-yl]-1,4-dioxaspiro[4.5]decane IUPAC Name: (7R,10S)-7-methyl-10-[(2R)-1-phenylsulfanyl-4-[(1S,2R,3R,4R)-1,2,4-trimethyl-7-oxabicyclo[2.2.1]heptan-3-yl]butan-2-yl]-1,4-dioxaspiro[4.5]decane Traditional Name: (7R,10S)-7-methyl-10-[(1R)-1-[(phenylthio)methyl]-3-[(1S,2R,3R,4R)-1,2,4-trimethyl-7-oxabicyclo[2.2.1]heptan-3-yl]propyl]-1,4-dioxaspiro[4.5]decane Formula: C28H42O3S MolecularWeight: 458.69628

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C2(C1)OCCO2)C(CCC3C(C4(CCC3(O4)C)C)C)CSC5=CC=CC=C5

Isomeric SMILES

C[C@@H]1CC[C@H](C2(C1)OCCO2)[C@@H](CC[C@@H]3[C@H]([C@@]4(CC[C@]3(O4)C)C)C)CSC5=CC=CC=C5

InChI

InChI=1S/C28H42O3S/c1-20-10-12-25(28(18-20)29-16-17-30-28)22(19-32-23-8-6-5-7-9-23)11-13-24-21(2)26(3)14-15-27(24,4)31-26/h5-9,20-22,24-25H,10-19H2,1-4H3/t20-,21-,22+,24-,25+,26+,27-/m1/s1