sodium;bis(5-[4-[3-[3-acetyloxy-3-(4-fluorophenyl)propyl]-1-(4-fluorophenyl)-4-oxoazetidin-2-yl]phenoxy]-5-oxopentanoic acid);5-O-[4-[3-[3-acetyloxy-3-(4-fluorophenyl)propyl]-1-(4-fluorophenyl)-4-oxoazetidin-2-yl]phenyl] 1-O-[2-[2-[2,6-dimethyl-8-(2-methylbutanoyloxy)-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]ethyl]-6-oxooxan-4-yl] pentanedioate;chloromethane;deuterioethyne;[1-(4-fluorophenyl)-3-[1-(4-fluorophenyl)-2-(4-hydroxyphenyl)-4-oxoazetidin-3-yl]propyl] acetate;hydride;[8-[2-(4-hydroxy-6-oxooxan-2-yl)ethyl]-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] 2-methylbutanoate;oxane-2,6-dione

C175H192ClF8N4NaO37 — CID 160589597

IUPACsodium;bis(5-[4-[3-[3-acetyloxy-3-(4-fluorophenyl)propyl]-1-(4-fluorophenyl)-4-oxoazetidin-2-yl]phenoxy]-5-oxopentanoic acid);5-O-[4-[3-[3-acetyloxy-3-(4-fluorophenyl)propyl]-1-(4-fluorophenyl)-4-oxoazetidin-2-yl]phenyl] 1-O-[2-[2-[2,6-dimethyl-8-(2-methylbutanoyloxy)-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]ethyl]-6-oxooxan-4-yl] pentanedioate;chloromethane;deuterioethyne;[1-(4-fluorophenyl)-3-[1-(4-fluorophenyl)-2-(4-hydroxyphenyl)-4-oxoazetidin-3-yl]propyl] acetate;hydride;[8-[2-(4-hydroxy-6-oxooxan-2-yl)ethyl]-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] 2-methylbutanoate;oxane-2,6-dione
SMILESCC(=O)OC(CCC1C(=O)N(c2ccc(F)cc2)C1c1ccc(O)cc1)c1ccc(F)cc1.CC(=O)OC(CCC1C(=O)N(c2ccc(F)cc2)C1c1ccc(OC(=O)CCCC(=O)O)cc1)c1ccc(F)cc1.CC(=O)OC(CCC1C(=O)N(c2ccc(F)cc2)C1c1ccc(OC(=O)CCCC(=O)O)cc1)c1ccc(F)cc1.CCC(C)C(=O)OC1CC(C)C=C2C=CC(C)C(CCC3CC(O)CC(=O)O3)C21.CCC(C)C(=O)OC1CC(C)C=C2C=CC(C)C(CCC3CC(OC(=O)CCCC(=O)Oc4ccc(C5C(CCC(OC(C)=O)c6ccc(F)cc6)C(=O)N5c5ccc(F)cc5)cc4)CC(=O)O3)C21.CCl.O=C1CCCC(=O)O1.[2H]C#C.[H-].[Na+]
InChIInChI=1S/C55H63F2NO11.2C31H29F2NO7.C26H23F2NO4.C24H36O5.C5H6O3.C2H2.CH3Cl.Na.H/c1-6-33(3)55(64)69-48-29-32(2)28-38-11-10-34(4)45(52(38)48)25-24-43-30-44(31-51(62)67-43)68-50(61)9-7-8-49(60)66-42-22-14-37(15-23-42)53-46(54(63)58(53)41-20-18-40(57)19-21-41)26-27-47(65-35(5)59)36-12-16-39(56)17-13-36;2*1-19(35)40-27(20-5-9-22(32)10-6-20)18-17-26-30(34(31(26)39)24-13-11-23(33)12-14-24)21-7-15-25(16-8-21)41-29(38)4-2-3-28(36)37;1-16(30)33-24(17-2-6-19(27)7-3-17)15-14-23-25(18-4-12-22(31)13-5-18)29(26(23)32)21-10-8-20(28)9-11-21;1-5-15(3)24(27)29-21-11-14(2)10-17-7-6-16(4)20(23(17)21)9-8-19-12-18(25)13-22(26)28-19;6-4-2-1-3-5(7)8-4;2*1-2;;/h10-23,28,32-34,43-48,52-53H,6-9,24-27,29-31H2,1-5H3;2*5-16,26-27,30H,2-4,17-18H2,1H3,(H,36,37);2-13,23-25,31H,14-15H2,1H3;6-7,10,14-16,18-21,23,25H,5,8-9,11-13H2,1-4H3;1-3H2;1-2H;1H3;;/q;;;;;;;;+1;-1/i;;;;;;1D;;;
InChIKeyGHOQRRSFNWZREJ-WPEJIVRLSA-N
MW3154.89 g/mol
LogP30.53
Rot. Bonds56

About sodium;bis(5-[4-[3-[3-acetyloxy-3-(4-fluorophenyl)propyl]-1-(4-fluorophenyl)-4-oxoazetidin-2-yl]phenoxy]-5-oxopentanoic acid);5-O-[4-[3-[3-acetyloxy-3-(4-fluorophenyl)propyl]-1-(4-fluorophenyl)-4-oxoazetidin-2-yl]phenyl] 1-O-[2-[2-[2,6-dimethyl-8-(2-methylbutanoyloxy)-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]ethyl]-6-oxooxan-4-yl] pentanedioate;chloromethane;deuterioethyne;[1-(4-fluorophenyl)-3-[1-(4-fluorophenyl)-2-(4-hydroxyphenyl)-4-oxoazetidin-3-yl]propyl] acetate;hydride;[8-[2-(4-hydroxy-6-oxooxan-2-yl)ethyl]-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] 2-methylbutanoate;oxane-2,6-dione

sodium;bis(5-[4-[3-[3-acetyloxy-3-(4-fluorophenyl)propyl]-1-(4-fluorophenyl)-4-oxoazetidin-2-yl]phenoxy]-5-oxopentanoic acid);5-O-[4-[3-[3-acetyloxy-3-(4-fluorophenyl)propyl]-1-(4-fluorophenyl)-4-oxoazetidin-2-yl]phenyl] 1-O-[2-[2-[2,6-dimethyl-8-(2-methylbutanoyloxy)-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]ethyl]-6-oxooxan-4-yl] pentanedioate;chloromethane;deuterioethyne;[1-(4-fluorophenyl)-3-[1-(4-fluorophenyl)-2-(4-hydroxyphenyl)-4-oxoazetidin-3-yl]propyl] acetate;hydride;[8-[2-(4-hydroxy-6-oxooxan-2-yl)ethyl]-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] 2-methylbutanoate;oxane-2,6-dione (PubChem CID 160589597) has the molecular formula C175H192ClF8N4NaO37 and a molecular weight of 3154.89 g/mol. Its IUPAC name is sodium;bis(5-[4-[3-[3-acetyloxy-3-(4-fluorophenyl)propyl]-1-(4-fluorophenyl)-4-oxoazetidin-2-yl]phenoxy]-5-oxopentanoic acid);5-O-[4-[3-[3-acetyloxy-3-(4-fluorophenyl)propyl]-1-(4-fluorophenyl)-4-oxoazetidin-2-yl]phenyl] 1-O-[2-[2-[2,6-dimethyl-8-(2-methylbutanoyloxy)-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]ethyl]-6-oxooxan-4-yl] pentanedioate;chloromethane;deuterioethyne;[1-(4-fluorophenyl)-3-[1-(4-fluorophenyl)-2-(4-hydroxyphenyl)-4-oxoazetidin-3-yl]propyl] acetate;hydride;[8-[2-(4-hydroxy-6-oxooxan-2-yl)ethyl]-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] 2-methylbutanoate;oxane-2,6-dione.

Molecular Properties

Compound Namesodium;bis(5-[4-[3-[3-acetyloxy-3-(4-fluorophenyl)propyl]-1-(4-fluorophenyl)-4-oxoazetidin-2-yl]phenoxy]-5-oxopentanoic acid);5-O-[4-[3-[3-acetyloxy-3-(4-fluorophenyl)propyl]-1-(4-fluorophenyl)-4-oxoazetidin-2-yl]phenyl] 1-O-[2-[2-[2,6-dimethyl-8-(2-methylbutanoyloxy)-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]ethyl]-6-oxooxan-4-yl] pentanedioate;chloromethane;deuterioethyne;[1-(4-fluorophenyl)-3-[1-(4-fluorophenyl)-2-(4-hydroxyphenyl)-4-oxoazetidin-3-yl]propyl] acetate;hydride;[8-[2-(4-hydroxy-6-oxooxan-2-yl)ethyl]-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] 2-methylbutanoate;oxane-2,6-dione
PubChem CID160589597
Molecular FormulaC175H192ClF8N4NaO37
Molecular Weight3154.89 g/mol
Exact Mass3152.28
IUPAC Namesodium;bis(5-[4-[3-[3-acetyloxy-3-(4-fluorophenyl)propyl]-1-(4-fluorophenyl)-4-oxoazetidin-2-yl]phenoxy]-5-oxopentanoic acid);5-O-[4-[3-[3-acetyloxy-3-(4-fluorophenyl)propyl]-1-(4-fluorophenyl)-4-oxoazetidin-2-yl]phenyl] 1-O-[2-[2-[2,6-dimethyl-8-(2-methylbutanoyloxy)-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]ethyl]-6-oxooxan-4-yl] pentanedioate;chloromethane;deuterioethyne;[1-(4-fluorophenyl)-3-[1-(4-fluorophenyl)-2-(4-hydroxyphenyl)-4-oxoazetidin-3-yl]propyl] acetate;hydride;[8-[2-(4-hydroxy-6-oxooxan-2-yl)ethyl]-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] 2-methylbutanoate;oxane-2,6-dione
SMILESCC(=O)OC(CCC1C(=O)N(c2ccc(F)cc2)C1c1ccc(O)cc1)c1ccc(F)cc1.CC(=O)OC(CCC1C(=O)N(c2ccc(F)cc2)C1c1ccc(OC(=O)CCCC(=O)O)cc1)c1ccc(F)cc1.CC(=O)OC(CCC1C(=O)N(c2ccc(F)cc2)C1c1ccc(OC(=O)CCCC(=O)O)cc1)c1ccc(F)cc1.CCC(C)C(=O)OC1CC(C)C=C2C=CC(C)C(CCC3CC(O)CC(=O)O3)C21.CCC(C)C(=O)OC1CC(C)C=C2C=CC(C)C(CCC3CC(OC(=O)CCCC(=O)Oc4ccc(C5C(CCC(OC(C)=O)c6ccc(F)cc6)C(=O)N5c5ccc(F)cc5)cc4)CC(=O)O3)C21.CCl.O=C1CCCC(=O)O1.[2H]C#C.[H-].[Na+]
InChIInChI=1S/C55H63F2NO11.2C31H29F2NO7.C26H23F2NO4.C24H36O5.C5H6O3.C2H2.CH3Cl.Na.H/c1-6-33(3)55(64)69-48-29-32(2)28-38-11-10-34(4)45(52(38)48)25-24-43-30-44(31-51(62)67-43)68-50(61)9-7-8-49(60)66-42-22-14-37(15-23-42)53-46(54(63)58(53)41-20-18-40(57)19-21-41)26-27-47(65-35(5)59)36-12-16-39(56)17-13-36;2*1-19(35)40-27(20-5-9-22(32)10-6-20)18-17-26-30(34(31(26)39)24-13-11-23(33)12-14-24)21-7-15-25(16-8-21)41-29(38)4-2-3-28(36)37;1-16(30)33-24(17-2-6-19(27)7-3-17)15-14-23-25(18-4-12-22(31)13-5-18)29(26(23)32)21-10-8-20(28)9-11-21;1-5-15(3)24(27)29-21-11-14(2)10-17-7-6-16(4)20(23(17)21)9-8-19-12-18(25)13-22(26)28-19;6-4-2-1-3-5(7)8-4;2*1-2;;/h10-23,28,32-34,43-48,52-53H,6-9,24-27,29-31H2,1-5H3;2*5-16,26-27,30H,2-4,17-18H2,1H3,(H,36,37);2-13,23-25,31H,14-15H2,1H3;6-7,10,14-16,18-21,23,25H,5,8-9,11-13H2,1-4H3;1-3H2;1-2H;1H3;;/q;;;;;;;;+1;-1/i;;;;;;1D;;;
InChIKeyGHOQRRSFNWZREJ-WPEJIVRLSA-N
XLogP30.53
TPSA555.27 Ų
H-Bond Donors4
H-Bond Acceptors35
Rotatable Bonds56
Heavy Atoms226
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003154.89
LogP ≤ 530.53
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1035

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'phenol_ester', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Analyze sodium;bis(5-[4-[3-[3-acetyloxy-3-(4-fluorophenyl)propyl]-1-(4-fluorophenyl)-4-oxoazetidin-2-yl]phenoxy]-5-oxopentanoic acid);5-O-[4-[3-[3-acetyloxy-3-(4-fluorophenyl)propyl]-1-(4-fluorophenyl)-4-oxoazetidin-2-yl]phenyl] 1-O-[2-[2-[2,6-dimethyl-8-(2-methylbutanoyloxy)-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]ethyl]-6-oxooxan-4-yl] pentanedioate;chloromethane;deuterioethyne;[1-(4-fluorophenyl)-3-[1-(4-fluorophenyl)-2-(4-hydroxyphenyl)-4-oxoazetidin-3-yl]propyl] acetate;hydride;[8-[2-(4-hydroxy-6-oxooxan-2-yl)ethyl]-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] 2-methylbutanoate;oxane-2,6-dione with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of sodium;bis(5-[4-[3-[3-acetyloxy-3-(4-fluorophenyl)propyl]-1-(4-fluorophenyl)-4-oxoazetidin-2-yl]phenoxy]-5-oxopentanoic acid);5-O-[4-[3-[3-acetyloxy-3-(4-fluorophenyl)propyl]-1-(4-fluorophenyl)-4-oxoazetidin-2-yl]phenyl] 1-O-[2-[2-[2,6-dimethyl-8-(2-methylbutanoyloxy)-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]ethyl]-6-oxooxan-4-yl] pentanedioate;chloromethane;deuterioethyne;[1-(4-fluorophenyl)-3-[1-(4-fluorophenyl)-2-(4-hydroxyphenyl)-4-oxoazetidin-3-yl]propyl] acetate;hydride;[8-[2-(4-hydroxy-6-oxooxan-2-yl)ethyl]-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] 2-methylbutanoate;oxane-2,6-dione?
The IUPAC name of sodium;bis(5-[4-[3-[3-acetyloxy-3-(4-fluorophenyl)propyl]-1-(4-fluorophenyl)-4-oxoazetidin-2-yl]phenoxy]-5-oxopentanoic acid);5-O-[4-[3-[3-acetyloxy-3-(4-fluorophenyl)propyl]-1-(4-fluorophenyl)-4-oxoazetidin-2-yl]phenyl] 1-O-[2-[2-[2,6-dimethyl-8-(2-methylbutanoyloxy)-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]ethyl]-6-oxooxan-4-yl] pentanedioate;chloromethane;deuterioethyne;[1-(4-fluorophenyl)-3-[1-(4-fluorophenyl)-2-(4-hydroxyphenyl)-4-oxoazetidin-3-yl]propyl] acetate;hydride;[8-[2-(4-hydroxy-6-oxooxan-2-yl)ethyl]-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] 2-methylbutanoate;oxane-2,6-dione (CID 160589597) is sodium;bis(5-[4-[3-[3-acetyloxy-3-(4-fluorophenyl)propyl]-1-(4-fluorophenyl)-4-oxoazetidin-2-yl]phenoxy]-5-oxopentanoic acid);5-O-[4-[3-[3-acetyloxy-3-(4-fluorophenyl)propyl]-1-(4-fluorophenyl)-4-oxoazetidin-2-yl]phenyl] 1-O-[2-[2-[2,6-dimethyl-8-(2-methylbutanoyloxy)-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]ethyl]-6-oxooxan-4-yl] pentanedioate;chloromethane;deuterioethyne;[1-(4-fluorophenyl)-3-[1-(4-fluorophenyl)-2-(4-hydroxyphenyl)-4-oxoazetidin-3-yl]propyl] acetate;hydride;[8-[2-(4-hydroxy-6-oxooxan-2-yl)ethyl]-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] 2-methylbutanoate;oxane-2,6-dione.
What is the SMILES notation for sodium;bis(5-[4-[3-[3-acetyloxy-3-(4-fluorophenyl)propyl]-1-(4-fluorophenyl)-4-oxoazetidin-2-yl]phenoxy]-5-oxopentanoic acid);5-O-[4-[3-[3-acetyloxy-3-(4-fluorophenyl)propyl]-1-(4-fluorophenyl)-4-oxoazetidin-2-yl]phenyl] 1-O-[2-[2-[2,6-dimethyl-8-(2-methylbutanoyloxy)-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]ethyl]-6-oxooxan-4-yl] pentanedioate;chloromethane;deuterioethyne;[1-(4-fluorophenyl)-3-[1-(4-fluorophenyl)-2-(4-hydroxyphenyl)-4-oxoazetidin-3-yl]propyl] acetate;hydride;[8-[2-(4-hydroxy-6-oxooxan-2-yl)ethyl]-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] 2-methylbutanoate;oxane-2,6-dione?
The canonical SMILES for sodium;bis(5-[4-[3-[3-acetyloxy-3-(4-fluorophenyl)propyl]-1-(4-fluorophenyl)-4-oxoazetidin-2-yl]phenoxy]-5-oxopentanoic acid);5-O-[4-[3-[3-acetyloxy-3-(4-fluorophenyl)propyl]-1-(4-fluorophenyl)-4-oxoazetidin-2-yl]phenyl] 1-O-[2-[2-[2,6-dimethyl-8-(2-methylbutanoyloxy)-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]ethyl]-6-oxooxan-4-yl] pentanedioate;chloromethane;deuterioethyne;[1-(4-fluorophenyl)-3-[1-(4-fluorophenyl)-2-(4-hydroxyphenyl)-4-oxoazetidin-3-yl]propyl] acetate;hydride;[8-[2-(4-hydroxy-6-oxooxan-2-yl)ethyl]-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] 2-methylbutanoate;oxane-2,6-dione is CC(=O)OC(CCC1C(=O)N(c2ccc(F)cc2)C1c1ccc(O)cc1)c1ccc(F)cc1.CC(=O)OC(CCC1C(=O)N(c2ccc(F)cc2)C1c1ccc(OC(=O)CCCC(=O)O)cc1)c1ccc(F)cc1.CC(=O)OC(CCC1C(=O)N(c2ccc(F)cc2)C1c1ccc(OC(=O)CCCC(=O)O)cc1)c1ccc(F)cc1.CCC(C)C(=O)OC1CC(C)C=C2C=CC(C)C(CCC3CC(O)CC(=O)O3)C21.CCC(C)C(=O)OC1CC(C)C=C2C=CC(C)C(CCC3CC(OC(=O)CCCC(=O)Oc4ccc(C5C(CCC(OC(C)=O)c6ccc(F)cc6)C(=O)N5c5ccc(F)cc5)cc4)CC(=O)O3)C21.CCl.O=C1CCCC(=O)O1.[2H]C#C.[H-].[Na+].
What is the InChIKey of sodium;bis(5-[4-[3-[3-acetyloxy-3-(4-fluorophenyl)propyl]-1-(4-fluorophenyl)-4-oxoazetidin-2-yl]phenoxy]-5-oxopentanoic acid);5-O-[4-[3-[3-acetyloxy-3-(4-fluorophenyl)propyl]-1-(4-fluorophenyl)-4-oxoazetidin-2-yl]phenyl] 1-O-[2-[2-[2,6-dimethyl-8-(2-methylbutanoyloxy)-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]ethyl]-6-oxooxan-4-yl] pentanedioate;chloromethane;deuterioethyne;[1-(4-fluorophenyl)-3-[1-(4-fluorophenyl)-2-(4-hydroxyphenyl)-4-oxoazetidin-3-yl]propyl] acetate;hydride;[8-[2-(4-hydroxy-6-oxooxan-2-yl)ethyl]-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] 2-methylbutanoate;oxane-2,6-dione?
The InChIKey is GHOQRRSFNWZREJ-WPEJIVRLSA-N. The full InChI is InChI=1S/C55H63F2NO11.2C31H29F2NO7.C26H23F2NO4.C24H36O5.C5H6O3.C2H2.CH3Cl.Na.H/c1-6-33(3)55(64)69-48-29-32(2)28-38-11-10-34(4)45(52(38)48)25-24-43-30-44(31-51(62)67-43)68-50(61)9-7-8-49(60)66-42-22-14-37(15-23-42)53-46(54(63)58(53)41-20-18-40(57)19-21-41)26-27-47(65-35(5)59)36-12-16-39(56)17-13-36;2*1-19(35)40-27(20-5-9-22(32)10-6-20)18-17-26-30(34(31(26)39)24-13-11-23(33)12-14-24)21-7-15-25(16-8-21)41-29(38)4-2-3-28(36)37;1-16(30)33-24(17-2-6-19(27)7-3-17)15-14-23-25(18-4-12-22(31)13-5-18)29(26(23)32)21-10-8-20(28)9-11-21;1-5-15(3)24(27)29-21-11-14(2)10-17-7-6-16(4)20(23(17)21)9-8-19-12-18(25)13-22(26)28-19;6-4-2-1-3-5(7)8-4;2*1-2;;/h10-23,28,32-34,43-48,52-53H,6-9,24-27,29-31H2,1-5H3;2*5-16,26-27,30H,2-4,17-18H2,1H3,(H,36,37);2-13,23-25,31H,14-15H2,1H3;6-7,10,14-16,18-21,23,25H,5,8-9,11-13H2,1-4H3;1-3H2;1-2H;1H3;;/q;;;;;;;;+1;-1/i;;;;;;1D;;;.
What are the key properties of sodium;bis(5-[4-[3-[3-acetyloxy-3-(4-fluorophenyl)propyl]-1-(4-fluorophenyl)-4-oxoazetidin-2-yl]phenoxy]-5-oxopentanoic acid);5-O-[4-[3-[3-acetyloxy-3-(4-fluorophenyl)propyl]-1-(4-fluorophenyl)-4-oxoazetidin-2-yl]phenyl] 1-O-[2-[2-[2,6-dimethyl-8-(2-methylbutanoyloxy)-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]ethyl]-6-oxooxan-4-yl] pentanedioate;chloromethane;deuterioethyne;[1-(4-fluorophenyl)-3-[1-(4-fluorophenyl)-2-(4-hydroxyphenyl)-4-oxoazetidin-3-yl]propyl] acetate;hydride;[8-[2-(4-hydroxy-6-oxooxan-2-yl)ethyl]-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] 2-methylbutanoate;oxane-2,6-dione?
sodium;bis(5-[4-[3-[3-acetyloxy-3-(4-fluorophenyl)propyl]-1-(4-fluorophenyl)-4-oxoazetidin-2-yl]phenoxy]-5-oxopentanoic acid);5-O-[4-[3-[3-acetyloxy-3-(4-fluorophenyl)propyl]-1-(4-fluorophenyl)-4-oxoazetidin-2-yl]phenyl] 1-O-[2-[2-[2,6-dimethyl-8-(2-methylbutanoyloxy)-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]ethyl]-6-oxooxan-4-yl] pentanedioate;chloromethane;deuterioethyne;[1-(4-fluorophenyl)-3-[1-(4-fluorophenyl)-2-(4-hydroxyphenyl)-4-oxoazetidin-3-yl]propyl] acetate;hydride;[8-[2-(4-hydroxy-6-oxooxan-2-yl)ethyl]-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] 2-methylbutanoate;oxane-2,6-dione has a molecular weight of 3154.89 g/mol, XLogP of 30.53, 56 rotatable bonds, 4 hydrogen bond donors, and 35 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;bis(5-[4-[3-[3-acetyloxy-3-(4-fluorophenyl)propyl]-1-(4-fluorophenyl)-4-oxoazetidin-2-yl]phenoxy]-5-oxopentanoic acid);5-O-[4-[3-[3-acetyloxy-3-(4-fluorophenyl)propyl]-1-(4-fluorophenyl)-4-oxoazetidin-2-yl]phenyl] 1-O-[2-[2-[2,6-dimethyl-8-(2-methylbutanoyloxy)-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]ethyl]-6-oxooxan-4-yl] pentanedioate;chloromethane;deuterioethyne;[1-(4-fluorophenyl)-3-[1-(4-fluorophenyl)-2-(4-hydroxyphenyl)-4-oxoazetidin-3-yl]propyl] acetate;hydride;[8-[2-(4-hydroxy-6-oxooxan-2-yl)ethyl]-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] 2-methylbutanoate;oxane-2,6-dione is sourced from PubChem (CID 160589597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).