N-[(1S,2R,3R,6S,8R,9R,10R,13E,16S,18R)-13-[[5-(6-azanylpyridin-2-yl)-1,3-thiazol-2-yl]methoxyimino]-9-[(2S,3R,4S,6R)-4-(dimethylamino)-6-methyl-3-oxidanyl-oxan-2-yl]oxy-3-ethyl-6-fluoranyl-2,6,8,10,16,18-hexamethyl-2-oxidanyl-5,7-bis(oxidanylidene)-4,11,15-trioxabicyclo[8.5.4]nonadecan-17-ylidene]-2-methyl-propanamide

Systemtic Name: N-[(1S,2R,3R,6S,8R,9R,10R,13E,16S,18R)-13-[[5-(6-azanylpyridin-2-yl)-1,3-thiazol-2-yl]methoxyimino]-9-[(2S,3R,4S,6R)-4-(dimethylamino)-6-methyl-3-oxidanyl-oxan-2-yl]oxy-3-ethyl-6-fluoranyl-2,6,8,10,16,18-hexamethyl-2-oxidanyl-5,7-bis(oxidanylidene)-4,11,15-trioxabicyclo[8.5.4]nonadecan-17-ylidene]-2-methyl-propanamide Openeye Name: N-[(1S,2R,3R,6S,8R,9R,10R,13E,16S,18R)-13-[[5-(6-amino-2-pyridyl)thiazol-2-yl]methoxyimino]-9-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-3-ethyl-6-fluoro-2-hydroxy-2,6,8,10,16,18-hexamethyl-5,7-dioxo-4,11,15-trioxabicyclo[8.5.4]nonadecan-17-ylidene]-2-methyl-propanamide CAS Name: N-[(1S,2R,3R,6S,8R,9R,10R,13E,16S,18R)-13-[[5-(6-amino-2-pyridinyl)-2-thiazolyl]methoxyimino]-9-[[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyl-2-oxanyl]oxy]-3-ethyl-6-fluoro-2-hydroxy-2,6,8,10,16,18-hexamethyl-5,7-dioxo-4,11,15-trioxabicyclo[8.5.4]nonadecan-17-ylidene]-2-methylpropanamide IUPAC Name: N-[(1S,2R,3R,6S,8R,9R,10R,13E,16S,18R)-13-[[5-(6-aminopyridin-2-yl)-1,3-thiazol-2-yl]methoxyimino]-9-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-3-ethyl-6-fluoro-2-hydroxy-2,6,8,10,16,18-hexamethyl-5,7-dioxo-4,11,15-trioxabicyclo[8.5.4]nonadecan-17-ylidene]-2-methylpropanamide Traditional Name: N-[(1S,2R,3R,6S,8R,9R,10R,13E,16S,18R)-13-[[5-(6-amino-2-pyridyl)thiazol-2-yl]methyloximino]-9-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-3-ethyl-6-fluoro-2-hydroxy-5,7-diketo-2,6,8,10,16,18-hexamethyl-4,11,15-trioxabicyclo[8.5.4]nonadecan-17-ylidene]-2-methyl-propionamide Formula: C45H67FN6O11S MolecularWeight: 919.110483

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(C2C(C(=NC(=O)C(C)C)C(CC(C(C(C(=O)C(C(=O)O1)(C)F)C)OC3C(C(CC(O3)C)N(C)C)O)(OCC(=NOCC4=NC=C(S4)C5=NC(=CC=C5)N)CO2)C)C)C)(C)O

Isomeric SMILES

CC[C@@H]1[C@@]([C@@H]2[C@H](C(=NC(=O)C(C)C)[C@@H](C[C@]([C@@H]([C@H](C(=O)[C@](C(=O)O1)(C)F)C)O[C@H]3[C@@H]([C@H](C[C@H](O3)C)N(C)C)O)(OC/C(=N/OCC4=NC=C(S4)C5=NC(=CC=C5)N)/CO2)C)C)C)(C)O

InChI

InChI=1S/C45H67FN6O11S/c1-13-32-45(10,57)39-26(6)35(50-40(55)23(2)3)24(4)18-43(8,59-21-28(20-58-39)51-60-22-34-48-19-31(64-34)29-15-14-16-33(47)49-29)38(27(7)37(54)44(9,46)42(56)62-32)63-41-36(53)30(52(11)12)17-25(5)61-41/h14-16,19,23-27,30,32,36,38-39,41,53,57H,13,17-18,20-22H2,1-12H3,(H2,47,49)/b50-35?,51-28+/t24-,25-,26+,27+,30+,32-,36-,38-,39+,41+,43-,44+,45-/m1/s1