(E)-7-[5-azido-2-[(E)-4-methyl-3-oxidanyl-non-1-en-6-ynyl]-3-oxidanyl-cyclopentyl]hept-5-enoic acid

Systemtic Name: (E)-7-[5-azido-2-[(E)-4-methyl-3-oxidanyl-non-1-en-6-ynyl]-3-oxidanyl-cyclopentyl]hept-5-enoic acid Openeye Name: (E)-7-[5-azido-3-hydroxy-2-[(E)-3-hydroxy-4-methyl-non-1-en-6-ynyl]cyclopentyl]hept-5-enoic acid CAS Name: (E)-7-[5-azido-3-hydroxy-2-[(E)-3-hydroxy-4-methylnon-1-en-6-ynyl]cyclopentyl]-5-heptenoic acid IUPAC Name: (E)-7-[5-azido-3-hydroxy-2-[(E)-3-hydroxy-4-methylnon-1-en-6-ynyl]cyclopentyl]hept-5-enoic acid Traditional Name: (E)-7-[5-azido-3-hydroxy-2-[(E)-3-hydroxy-4-methyl-non-1-en-6-ynyl]cyclopentyl]hept-5-enoic acid Formula: C22H33N3O4 MolecularWeight: 403.51512

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H33N3O4/c1-3-4-7-10-16(2)20(26)14-13-18-17(19(24-25-23)15-21(18)27)11-8-5-6-9-12-22(28)29/h5,8,13-14,16-21,26-27H,3,6,9-12,15H2,1-2H3,(H,28,29)/b8-5+,14-13+