2,6-dimethyl-4-pentyl-hepta-2,5-diene-3,4,5-triol phosphate

Systemtic Name: 2,6-dimethyl-4-pentyl-hepta-2,5-diene-3,4,5-triol phosphate Openeye Name: 2,6-dimethyl-4-pentyl-hepta-2,5-diene-3,4,5-triol phosphate CAS Name: 2,6-dimethyl-4-pentylhepta-2,5-diene-3,4,5-triol phosphate IUPAC Name: 2,6-dimethyl-4-pentylhepta-2,5-diene-3,4,5-triol phosphate Traditional Name: 4-amyl-2,6-dimethyl-hepta-2,5-diene-3,4,5-triol phosphate Formula: C14H26O7P-3 MolecularWeight: 337.325801

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C(=C(C)C)O)(C(=C(C)C)O)O.[O-]P(=O)([O-])[O-]

Isomeric SMILES

CCCCCC(C(=C(C)C)O)(C(=C(C)C)O)O.[O-]P(=O)([O-])[O-]

InChI

InChI=1S/C14H26O3.H3O4P/c1-6-7-8-9-14(17,12(15)10(2)3)13(16)11(4)5;1-5(2,3)4/h15-17H,6-9H2,1-5H3;(H3,1,2,3,4)/p-3