(3E,5Z,7S)-5-(hydroxymethyl)-7-oxidanyl-octa-3,5-dien-2-one

Systemtic Name: (3E,5Z,7S)-5-(hydroxymethyl)-7-oxidanyl-octa-3,5-dien-2-one Openeye Name: (3E,5Z,7S)-7-hydroxy-5-(hydroxymethyl)octa-3,5-dien-2-one CAS Name: (3E,5Z,7S)-7-hydroxy-5-(hydroxymethyl)-2-octa-3,5-dienone IUPAC Name: (3E,5Z,7S)-7-hydroxy-5-(hydroxymethyl)octa-3,5-dien-2-one Traditional Name: (3E,5Z,7S)-7-hydroxy-5-methylol-octa-3,5-dien-2-one Formula: C9H14O3 MolecularWeight: 170.20566

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Descriptors Computed from Structure

Canonical SMILES:

CC(C=C(CO)C=CC(=O)C)O

Isomeric SMILES

C[C@@H](/C=C(\CO)/C=C/C(=O)C)O

InChI

InChI=1S/C9H14O3/c1-7(11)3-4-9(6-10)5-8(2)12/h3-5,8,10,12H,6H2,1-2H3/b4-3+,9-5-/t8-/m0/s1