(4Z,7S,11S,14R,15S,16R)-7-[(Z)-1-fluoranyl-2-pyridin-2-yl-ethenyl]-4,12,12,14,16-pentamethyl-11,15-bis(oxidanyl)-1-oxa-8-azacyclohexadec-4-ene-9,13-dione

Systemtic Name: (4Z,7S,11S,14R,15S,16R)-7-[(Z)-1-fluoranyl-2-pyridin-2-yl-ethenyl]-4,12,12,14,16-pentamethyl-11,15-bis(oxidanyl)-1-oxa-8-azacyclohexadec-4-ene-9,13-dione Openeye Name: (4Z,7S,11S,14R,15S,16R)-7-[(Z)-1-fluoro-2-(2-pyridyl)vinyl]-11,15-dihydroxy-4,12,12,14,16-pentamethyl-1-oxa-8-azacyclohexadec-4-ene-9,13-dione CAS Name: (4Z,7S,11S,14R,15S,16R)-7-[(Z)-1-fluoro-2-(2-pyridinyl)ethenyl]-11,15-dihydroxy-4,12,12,14,16-pentamethyl-1-oxa-8-azacyclohexadec-4-ene-9,13-dione IUPAC Name: (4Z,7S,11S,14R,15S,16R)-7-[(Z)-1-fluoro-2-pyridin-2-ylethenyl]-11,15-dihydroxy-4,12,12,14,16-pentamethyl-1-oxa-8-azacyclohexadec-4-ene-9,13-dione Traditional Name: (4Z,7S,11S,14R,15S,16R)-7-[(Z)-1-fluoro-2-(2-pyridyl)vinyl]-11,15-dihydroxy-4,12,12,14,16-pentamethyl-1-oxa-8-azacyclohexadec-4-ene-9,13-quinone Formula: C26H37FN2O5 MolecularWeight: 476.580783

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(OCCC(=CCC(NC(=O)CC(C(C1=O)(C)C)O)C(=CC2=CC=CC=N2)F)C)C)O

Isomeric SMILES

C[C@@H]1[C@@H]([C@H](OCC/C(=C\C[C@H](NC(=O)C[C@@H](C(C1=O)(C)C)O)/C(=C/C2=CC=CC=N2)/F)/C)C)O

InChI

InChI=1S/C26H37FN2O5/c1-16-9-10-21(20(27)14-19-8-6-7-12-28-19)29-23(31)15-22(30)26(4,5)25(33)17(2)24(32)18(3)34-13-11-16/h6-9,12,14,17-18,21-22,24,30,32H,10-11,13,15H2,1-5H3,(H,29,31)/b16-9-,20-14-/t17-,18-,21+,22+,24+/m1/s1