(E,9R,10R)-1-phenylheptadec-1-en-4,6-diyne-3,9,10-triol

Systemtic Name: (E,9R,10R)-1-phenylheptadec-1-en-4,6-diyne-3,9,10-triol Openeye Name: (E,9R,10R)-1-phenylheptadec-1-en-4,6-diyne-3,9,10-triol CAS Name: (E,9R,10R)-1-phenylheptadec-1-en-4,6-diyne-3,9,10-triol IUPAC Name: (E,9R,10R)-1-phenylheptadec-1-en-4,6-diyne-3,9,10-triol Traditional Name: (E,9R,10R)-1-phenylheptadec-1-en-4,6-diyne-3,9,10-triol Formula: C23H30O3 MolecularWeight: 354.4825

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(C(CC#CC#CC(C=CC1=CC=CC=C1)O)O)O

Isomeric SMILES

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

InChI

InChI=1S/C23H30O3/c1-2-3-4-5-11-16-22(25)23(26)17-12-7-10-15-21(24)19-18-20-13-8-6-9-14-20/h6,8-9,13-14,18-19,21-26H,2-5,11,16-17H2,1H3/b19-18+/t21?,22-,23-/m1/s1