(E,1R,3S,7R)-1-phenyldodec-4-ene-1,3,7-triol

Systemtic Name: (E,1R,3S,7R)-1-phenyldodec-4-ene-1,3,7-triol Openeye Name: (E,1R,3S,7R)-1-phenyldodec-4-ene-1,3,7-triol CAS Name: (E,1R,3S,7R)-1-phenyl-4-dodecene-1,3,7-triol IUPAC Name: (E,1R,3S,7R)-1-phenyldodec-4-ene-1,3,7-triol Traditional Name: (E,1R,3S,7R)-1-phenyldodec-4-ene-1,3,7-triol Formula: C18H28O3 MolecularWeight: 292.41312

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC=CC(CC(C1=CC=CC=C1)O)O)O

Isomeric SMILES

CCCCC[C@H](C/C=C/[C@H](C[C@H](C1=CC=CC=C1)O)O)O

InChI

InChI=1S/C18H28O3/c1-2-3-5-11-16(19)12-8-13-17(20)14-18(21)15-9-6-4-7-10-15/h4,6-10,13,16-21H,2-3,5,11-12,14H2,1H3/b13-8+/t16-,17-,18-/m1/s1