(4Z,7S,11S,14R,15S,16R)-7-[(Z)-1-fluoranyl-2-(2-methyl-1,3-oxazol-4-yl)ethenyl]-4,12,12,16-tetramethyl-11,15-bis(oxidanyl)-14-prop-2-enyl-1-oxa-8-azacyclohexadec-4-ene-9,13-dione

Systemtic Name: (4Z,7S,11S,14R,15S,16R)-7-[(Z)-1-fluoranyl-2-(2-methyl-1,3-oxazol-4-yl)ethenyl]-4,12,12,16-tetramethyl-11,15-bis(oxidanyl)-14-prop-2-enyl-1-oxa-8-azacyclohexadec-4-ene-9,13-dione Openeye Name: (4Z,7S,11S,14R,15S,16R)-14-allyl-7-[(Z)-1-fluoro-2-(2-methyloxazol-4-yl)vinyl]-11,15-dihydroxy-4,12,12,16-tetramethyl-1-oxa-8-azacyclohexadec-4-ene-9,13-dione CAS Name: (4Z,7S,11S,14R,15S,16R)-7-[(Z)-1-fluoro-2-(2-methyl-4-oxazolyl)ethenyl]-11,15-dihydroxy-4,12,12,16-tetramethyl-14-prop-2-enyl-1-oxa-8-azacyclohexadec-4-ene-9,13-dione IUPAC Name: (4Z,7S,11S,14R,15S,16R)-7-[(Z)-1-fluoro-2-(2-methyl-1,3-oxazol-4-yl)ethenyl]-11,15-dihydroxy-4,12,12,16-tetramethyl-14-prop-2-enyl-1-oxa-8-azacyclohexadec-4-ene-9,13-dione Traditional Name: (4Z,7S,11S,14R,15S,16R)-14-allyl-7-[(Z)-1-fluoro-2-(2-methyloxazol-4-yl)vinyl]-11,15-dihydroxy-4,12,12,16-tetramethyl-1-oxa-8-azacyclohexadec-4-ene-9,13-quinone Formula: C27H39FN2O6 MolecularWeight: 506.606763

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(C(=O)C(C(CC(=O)NC(CC=C(CCO1)C)C(=CC2=COC(=N2)C)F)O)(C)C)CC=C)O

Isomeric SMILES

C[C@@H]1[C@H]([C@H](C(=O)C([C@H](CC(=O)N[C@@H](C/C=C(\CCO1)/C)/C(=C/C2=COC(=N2)C)/F)O)(C)C)CC=C)O

InChI

InChI=1S/C27H39FN2O6/c1-7-8-20-25(33)17(3)35-12-11-16(2)9-10-22(21(28)13-19-15-36-18(4)29-19)30-24(32)14-23(31)27(5,6)26(20)34/h7,9,13,15,17,20,22-23,25,31,33H,1,8,10-12,14H2,2-6H3,(H,30,32)/b16-9-,21-13-/t17-,20-,22+,23+,25-/m1/s1