(4S,5R,6R)-6-methyl-4-[(2-methyl-1,3-dioxolan-2-yl)methyl]-5-oxidanyl-7-phenylmethoxy-heptan-3-one

Systemtic Name: (4S,5R,6R)-6-methyl-4-[(2-methyl-1,3-dioxolan-2-yl)methyl]-5-oxidanyl-7-phenylmethoxy-heptan-3-one Openeye Name: (4S,5R,6R)-7-benzyloxy-5-hydroxy-6-methyl-4-[(2-methyl-1,3-dioxolan-2-yl)methyl]heptan-3-one CAS Name: (4S,5R,6R)-5-hydroxy-6-methyl-4-[(2-methyl-1,3-dioxolan-2-yl)methyl]-7-phenylmethoxy-3-heptanone IUPAC Name: (4S,5R,6R)-5-hydroxy-6-methyl-4-[(2-methyl-1,3-dioxolan-2-yl)methyl]-7-phenylmethoxyheptan-3-one Traditional Name: (4S,5R,6R)-7-benzoxy-5-hydroxy-6-methyl-4-[(2-methyl-1,3-dioxolan-2-yl)methyl]heptan-3-one Formula: C20H30O5 MolecularWeight: 350.4492

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(CC1(OCCO1)C)C(C(C)COCC2=CC=CC=C2)O

Isomeric SMILES

CCC(=O)[C@@H](CC1(OCCO1)C)[C@@H]([C@H](C)COCC2=CC=CC=C2)O

InChI

InChI=1S/C20H30O5/c1-4-18(21)17(12-20(3)24-10-11-25-20)19(22)15(2)13-23-14-16-8-6-5-7-9-16/h5-9,15,17,19,22H,4,10-14H2,1-3H3/t15-,17-,19-/m1/s1