14-oxabicyclo[25.4.0]hentriaconta-1(27),28,30-triene-28-sulfonic acid

Systemtic Name: 14-oxabicyclo[25.4.0]hentriaconta-1(27),28,30-triene-28-sulfonic acid Openeye Name: 14-oxabicyclo[25.4.0]hentriaconta-1(27),28,30-triene-28-sulfonic acid CAS Name: 14-oxabicyclo[25.4.0]hentriaconta-1(27),28,30-triene-28-sulfonic acid IUPAC Name: 14-oxabicyclo[25.4.0]hentriaconta-1(27),28,30-triene-28-sulfonic acid Traditional Name: 14-oxabicyclo[25.4.0]hentriaconta-1(27),28,30-triene-28-sulfonic acid Formula: C30H52O4S MolecularWeight: 508.79648

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCCCCOCCCCCCCCCCCCC2=C(CCCCC1)C=CC=C2S(=O)(=O)O

Isomeric SMILES

C1CCCCCCOCCCCCCCCCCCCC2=C(CCCCC1)C=CC=C2S(=O)(=O)O

InChI

InChI=1S/C30H52O4S/c31-35(32,33)30-25-21-23-28-22-17-13-9-5-1-3-7-11-15-19-26-34-27-20-16-12-8-4-2-6-10-14-18-24-29(28)30/h21,23,25H,1-20,22,24,26-27H2,(H,31,32,33)