(E)-7-[5-azido-2-[(1E)-7-methyl-3-oxidanyl-octa-1,6-dienyl]-3-oxidanyl-cyclopentyl]hept-5-enoic acid

Systemtic Name: (E)-7-[5-azido-2-[(1E)-7-methyl-3-oxidanyl-octa-1,6-dienyl]-3-oxidanyl-cyclopentyl]hept-5-enoic acid Openeye Name: (E)-7-[5-azido-3-hydroxy-2-[(1E)-3-hydroxy-7-methyl-octa-1,6-dienyl]cyclopentyl]hept-5-enoic acid CAS Name: (E)-7-[5-azido-3-hydroxy-2-[(1E)-3-hydroxy-7-methylocta-1,6-dienyl]cyclopentyl]-5-heptenoic acid IUPAC Name: (E)-7-[5-azido-3-hydroxy-2-[(1E)-3-hydroxy-7-methylocta-1,6-dienyl]cyclopentyl]hept-5-enoic acid Traditional Name: (E)-7-[5-azido-3-hydroxy-2-[(1E)-3-hydroxy-7-methyl-octa-1,6-dienyl]cyclopentyl]hept-5-enoic acid Formula: C21H33N3O4 MolecularWeight: 391.50442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC(C=CC1C(CC(C1CC=CCCCC(=O)O)N=[N+]=[N-])O)O)C

Isomeric SMILES

CC(=CCCC(/C=C/C1C(CC(C1C/C=C/CCCC(=O)O)N=[N+]=[N-])O)O)C

InChI

InChI=1S/C21H33N3O4/c1-15(2)8-7-9-16(25)12-13-18-17(19(23-24-22)14-20(18)26)10-5-3-4-6-11-21(27)28/h3,5,8,12-13,16-20,25-26H,4,6-7,9-11,14H2,1-2H3,(H,27,28)/b5-3+,13-12+