[(E,1R,2R)-1-[(5R,11S,14S,17S,20S,23R,26S,29S,32R)-5-ethyl-1,7,10,16,20,23,25,28,31-nonamethyl-11,17,26,29-tetrakis(2-methylpropyl)-3,6,9,12,15,18,21,24,27,30,33-undecakis(oxidanylidene)-14,32-di(propan-2-yl)-1,4,7,10,13,16,19,22,25,28,31-undecazacyclotritriacont-2-yl]-2-methyl-hex-4-enyl] 2-[2-(2-methoxyethoxy)ethoxy]ethanoate

Systemtic Name: [(E,1R,2R)-1-[(5R,11S,14S,17S,20S,23R,26S,29S,32R)-5-ethyl-1,7,10,16,20,23,25,28,31-nonamethyl-11,17,26,29-tetrakis(2-methylpropyl)-3,6,9,12,15,18,21,24,27,30,33-undecakis(oxidanylidene)-14,32-di(propan-2-yl)-1,4,7,10,13,16,19,22,25,28,31-undecazacyclotritriacont-2-yl]-2-methyl-hex-4-enyl] 2-[2-(2-methoxyethoxy)ethoxy]ethanoate Openeye Name: [(E,1R,2R)-1-[(5R,11S,14S,17S,20S,23R,26S,29S,32R)-5-ethyl-11,17,26,29-tetraisobutyl-14,32-diisopropyl-1,7,10,16,20,23,25,28,31-nonamethyl-3,6,9,12,15,18,21,24,27,30,33-undecaoxo-1,4,7,10,13,16,19,22,25,28,31-undecazacyclotritriacont-2-yl]-2-methyl-hex-4-enyl] 2-[2-(2-methoxyethoxy)ethoxy]acetate CAS Name: 2-[2-(2-methoxyethoxy)ethoxy]acetic acid [(E,1R,2R)-1-[(5R,11S,14S,17S,20S,23R,26S,29S,32R)-5-ethyl-1,7,10,16,20,23,25,28,31-nonamethyl-11,17,26,29-tetrakis(2-methylpropyl)-3,6,9,12,15,18,21,24,27,30,33-undecaoxo-14,32-di(propan-2-yl)-1,4,7,10,13,16,19,22,25,28,31-undecazacyclotritriacont-2-yl]-2-methylhex-4-enyl] ester IUPAC Name: [(E,1R,2R)-1-[(5R,11S,14S,17S,20S,23R,26S,29S,32R)-5-ethyl-1,7,10,16,20,23,25,28,31-nonamethyl-11,17,26,29-tetrakis(2-methylpropyl)-3,6,9,12,15,18,21,24,27,30,33-undecaoxo-14,32-di(propan-2-yl)-1,4,7,10,13,16,19,22,25,28,31-undecazacyclotritriacont-2-yl]-2-methylhex-4-enyl] 2-[2-(2-methoxyethoxy)ethoxy]acetate Traditional Name: 2-[2-(2-methoxyethoxy)ethoxy]acetic acid [(E,1R,2R)-1-[(5R,11S,14S,17S,20S,23R,26S,29S,32R)-5-ethyl-11,17,26,29-tetraisobutyl-14,32-diisopropyl-3,6,9,12,15,18,21,24,27,30,33-undecaketo-1,7,10,16,20,23,25,28,31-nonamethyl-1,4,7,10,13,16,19,22,25,28,31-undecazacyclotritriacont-2-yl]-2-methyl-hex-4-enyl] ester Formula: C69H123N11O16 MolecularWeight: 1362.77902

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N(CC(=O)N(C(C(=O)NC(C(=O)N(C(C(=O)NC(C(=O)NC(C(=O)N(C(C(=O)N(C(C(=O)N(C(C(=O)N(C(C(=O)N1)C(C(C)CC=CC)OC(=O)COCCOCCOC)C)C(C)C)C)CC(C)C)C)CC(C)C)C)C)C)CC(C)C)C)C(C)C)CC(C)C)C)C

Isomeric SMILES

CC[C@@H]1C(=O)N(CC(=O)N([C@H](C(=O)N[C@H](C(=O)N([C@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N([C@H](C(=O)N([C@H](C(=O)N([C@@H](C(=O)N(C(C(=O)N1)[C@@H]([C@H](C)C/C=C/C)OC(=O)COCCOCCOC)C)C(C)C)C)CC(C)C)C)CC(C)C)C)C)C)CC(C)C)C)C(C)C)CC(C)C)C)C

InChI

InChI=1S/C69H123N11O16/c1-26-28-29-46(15)59(96-55(82)39-95-33-32-94-31-30-93-25)58-63(86)72-49(27-2)65(88)74(18)38-54(81)75(19)50(34-40(3)4)62(85)73-56(44(11)12)68(91)76(20)51(35-41(5)6)61(84)70-47(16)60(83)71-48(17)64(87)77(21)52(36-42(7)8)66(89)78(22)53(37-43(9)10)67(90)79(23)57(45(13)14)69(92)80(58)24/h26,28,40-53,56-59H,27,29-39H2,1-25H3,(H,70,84)(H,71,83)(H,72,86)(H,73,85)/b28-26+/t46-,47+,48-,49-,50+,51+,52+,53+,56+,57-,58?,59-/m1/s1