N-[2-[3-[11-[4-(dimethylamino)-6-methyl-3-oxidanyl-oxan-2-yl]oxy-13-[4,6-dimethyl-4,5-bis(oxidanyl)oxan-2-yl]oxy-2-ethyl-3,5,8,10,12,14-hexamethyl-3,4,10-tris(oxidanyl)-15-oxidanylidene-1-oxa-6-azacyclopentadec-6-yl]propylamino]-2-oxidanylidene-ethyl]-2-[[2-[2-[2-(3-fluoranyl-4-phenyl-phenyl)propanoylamino]ethanoylamino]-3-phenyl-propanoyl]amino]-4-methyl-pentanamide

Systemtic Name: N-[2-[3-[11-[4-(dimethylamino)-6-methyl-3-oxidanyl-oxan-2-yl]oxy-13-[4,6-dimethyl-4,5-bis(oxidanyl)oxan-2-yl]oxy-2-ethyl-3,5,8,10,12,14-hexamethyl-3,4,10-tris(oxidanyl)-15-oxidanylidene-1-oxa-6-azacyclopentadec-6-yl]propylamino]-2-oxidanylidene-ethyl]-2-[[2-[2-[2-(3-fluoranyl-4-phenyl-phenyl)propanoylamino]ethanoylamino]-3-phenyl-propanoyl]amino]-4-methyl-pentanamide Openeye Name: N-[2-[3-[13-(4,5-dihydroxy-4,6-dimethyl-tetrahydropyran-2-yl)oxy-11-[4-(dimethylamino)-3-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-2-ethyl-3,4,10-trihydroxy-3,5,8,10,12,14-hexamethyl-15-oxo-1-oxa-6-azacyclopentadec-6-yl]propylamino]-2-oxo-ethyl]-2-[[2-[[2-[2-(3-fluoro-4-phenyl-phenyl)propanoylamino]acetyl]amino]-3-phenyl-propanoyl]amino]-4-methyl-pentanamide CAS Name: N-[2-[3-[13-[(4,5-dihydroxy-4,6-dimethyl-2-oxanyl)oxy]-11-[[4-(dimethylamino)-3-hydroxy-6-methyl-2-oxanyl]oxy]-2-ethyl-3,4,10-trihydroxy-3,5,8,10,12,14-hexamethyl-15-oxo-1-oxa-6-azacyclopentadec-6-yl]propylamino]-2-oxoethyl]-2-[[2-[[2-[[2-(3-fluoro-4-phenylphenyl)-1-oxopropyl]amino]-1-oxoethyl]amino]-1-oxo-3-phenylpropyl]amino]-4-methylpentanamide IUPAC Name: N-[2-[3-[13-(4,5-dihydroxy-4,6-dimethyloxan-2-yl)oxy-11-[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-2-ethyl-3,4,10-trihydroxy-3,5,8,10,12,14-hexamethyl-15-oxo-1-oxa-6-azacyclopentadec-6-yl]propylamino]-2-oxoethyl]-2-[[2-[[2-[2-(3-fluoro-4-phenylphenyl)propanoylamino]acetyl]amino]-3-phenylpropanoyl]amino]-4-methylpentanamide Traditional Name: N-[2-[3-[13-(4,5-dihydroxy-4,6-dimethyl-tetrahydropyran-2-yl)oxy-11-[4-(dimethylamino)-3-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-2-ethyl-3,4,10-trihydroxy-15-keto-3,5,8,10,12,14-hexamethyl-1-oxa-6-azacyclopentadec-6-yl]propylamino]-2-keto-ethyl]-2-[[2-[[2-[2-(3-fluoro-4-phenyl-phenyl)propanoylamino]acetyl]amino]-3-phenyl-propanoyl]amino]-4-methyl-valeramide Formula: C73H112FN7O17 MolecularWeight: 1378.705483

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(C(C(N(CC(CC(C(C(C(C(C(=O)O1)C)OC2CC(C(C(O2)C)O)(C)O)C)OC3C(C(CC(O3)C)N(C)C)O)(C)O)C)CCCNC(=O)CNC(=O)C(CC(C)C)NC(=O)C(CC4=CC=CC=C4)NC(=O)CNC(=O)C(C)C5=CC(=C(C=C5)C6=CC=CC=C6)F)C)O)(C)O

Isomeric SMILES

CCC1C(C(C(N(CC(CC(C(C(C(C(C(=O)O1)C)OC2CC(C(C(O2)C)O)(C)O)C)OC3C(C(CC(O3)C)N(C)C)O)(C)O)C)CCCNC(=O)CNC(=O)C(CC(C)C)NC(=O)C(CC4=CC=CC=C4)NC(=O)CNC(=O)C(C)C5=CC(=C(C=C5)C6=CC=CC=C6)F)C)O)(C)O

InChI

InChI=1S/C73H112FN7O17/c1-16-57-73(13,93)63(85)47(9)81(40-42(4)36-72(12,92)65(98-70-61(84)56(80(14)15)33-43(5)94-70)45(7)62(46(8)69(90)96-57)97-60-37-71(11,91)64(86)48(10)95-60)31-23-30-75-58(82)38-77-67(88)54(32-41(2)3)79-68(89)55(34-49-24-19-17-20-25-49)78-59(83)39-76-66(87)44(6)51-28-29-52(53(74)35-51)50-26-21-18-22-27-50/h17-22,24-29,35,41-48,54-57,60-65,70,84-86,91-93H,16,23,30-34,36-40H2,1-15H3,(H,75,82)(H,76,87)(H,77,88)(H,78,83)(H,79,89)