[(3R,4S,5R,6R,7R)-4,6-dimethyl-5,7-bis(oxidanyl)nonan-3-yl] propanoate

Systemtic Name: [(3R,4S,5R,6R,7R)-4,6-dimethyl-5,7-bis(oxidanyl)nonan-3-yl] propanoate Openeye Name: [(1R,2S,3R,4R,5R)-1-ethyl-3,5-dihydroxy-2,4-dimethyl-heptyl] propanoate CAS Name: propanoic acid [(3R,4S,5R,6R,7R)-5,7-dihydroxy-4,6-dimethylnonan-3-yl] ester IUPAC Name: [(3R,4S,5R,6R,7R)-5,7-dihydroxy-4,6-dimethylnonan-3-yl] propanoate Traditional Name: propionic acid [(1R,2S,3R,4R,5R)-1-ethyl-3,5-dihydroxy-2,4-dimethyl-heptyl] ester Formula: C14H28O4 MolecularWeight: 260.36972

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C)C(C(C)C(CC)OC(=O)CC)O)O

Isomeric SMILES

CC[C@H]([C@@H](C)[C@H]([C@H](C)[C@@H](CC)OC(=O)CC)O)O

InChI

InChI=1S/C14H28O4/c1-6-11(15)9(4)14(17)10(5)12(7-2)18-13(16)8-3/h9-12,14-15,17H,6-8H2,1-5H3/t9-,10-,11-,12-,14-/m1/s1