16-[2-[9-[(2R,3R,4R,5R,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-oxononoxy]ethoxy]-4-butoxycarbonyl-6-[2-(dimethylamino)ethoxycarbonyl]-2-[2-ethylsulfanylcarbothioylsulfanyl-2-methyl-3-oxo-3-[2-(pyridin-2-yldisulfanyl)ethoxy]propyl]-10-isocyano-8-(2-methoxyethoxycarbonyl)-4,6,8,10-tetramethyl-13-oxo-2-propylhexadecanoic acid;16-[2-[6-[2-[9-[(2R,3R,4R,5R,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-oxononoxy]ethoxy]-3-oxohexoxy]ethoxy]-4-butoxycarbonyl-6-[2-(dimethylamino)ethoxycarbonyl]-2-[2-ethylsulfanylcarbothioylsulfanyl-2-methyl-3-oxo-3-[2-(pyridin-2-yldisulfanyl)ethoxy]propyl]-10-isocyano-8-(2-methoxyethoxycarbonyl)-4,6,8,10-tetramethyl-13-oxo-2-propylhexadecanoic acid

C150H246N8O45S10 — CID 158123000

About 16-[2-[9-[(2R,3R,4R,5R,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-oxononoxy]ethoxy]-4-butoxycarbonyl-6-[2-(dimethylamino)ethoxycarbonyl]-2-[2-ethylsulfanylcarbothioylsulfanyl-2-methyl-3-oxo-3-[2-(pyridin-2-yldisulfanyl)ethoxy]propyl]-10-isocyano-8-(2-methoxyethoxycarbonyl)-4,6,8,10-tetramethyl-13-oxo-2-propylhexadecanoic acid;16-[2-[6-[2-[9-[(2R,3R,4R,5R,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-oxononoxy]ethoxy]-3-oxohexoxy]ethoxy]-4-butoxycarbonyl-6-[2-(dimethylamino)ethoxycarbonyl]-2-[2-ethylsulfanylcarbothioylsulfanyl-2-methyl-3-oxo-3-[2-(pyridin-2-yldisulfanyl)ethoxy]propyl]-10-isocyano-8-(2-methoxyethoxycarbonyl)-4,6,8,10-tetramethyl-13-oxo-2-propylhexadecanoic acid

16-[2-[9-[(2R,3R,4R,5R,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-oxononoxy]ethoxy]-4-butoxycarbonyl-6-[2-(dimethylamino)ethoxycarbonyl]-2-[2-ethylsulfanylcarbothioylsulfanyl-2-methyl-3-oxo-3-[2-(pyridin-2-yldisulfanyl)ethoxy]propyl]-10-isocyano-8-(2-methoxyethoxycarbonyl)-4,6,8,10-tetramethyl-13-oxo-2-propylhexadecanoic acid;16-[2-[6-[2-[9-[(2R,3R,4R,5R,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-oxononoxy]ethoxy]-3-oxohexoxy]ethoxy]-4-butoxycarbonyl-6-[2-(dimethylamino)ethoxycarbonyl]-2-[2-ethylsulfanylcarbothioylsulfanyl-2-methyl-3-oxo-3-[2-(pyridin-2-yldisulfanyl)ethoxy]propyl]-10-isocyano-8-(2-methoxyethoxycarbonyl)-4,6,8,10-tetramethyl-13-oxo-2-propylhexadecanoic acid (PubChem CID 158123000) has the molecular formula C150H246N8O45S10 and a molecular weight of 3202.30 g/mol. Its IUPAC name is 16-[2-[9-[(2R,3R,4R,5R,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-oxononoxy]ethoxy]-4-butoxycarbonyl-6-[2-(dimethylamino)ethoxycarbonyl]-2-[2-ethylsulfanylcarbothioylsulfanyl-2-methyl-3-oxo-3-[2-(pyridin-2-yldisulfanyl)ethoxy]propyl]-10-isocyano-8-(2-methoxyethoxycarbonyl)-4,6,8,10-tetramethyl-13-oxo-2-propylhexadecanoic acid;16-[2-[6-[2-[9-[(2R,3R,4R,5R,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-oxononoxy]ethoxy]-3-oxohexoxy]ethoxy]-4-butoxycarbonyl-6-[2-(dimethylamino)ethoxycarbonyl]-2-[2-ethylsulfanylcarbothioylsulfanyl-2-methyl-3-oxo-3-[2-(pyridin-2-yldisulfanyl)ethoxy]propyl]-10-isocyano-8-(2-methoxyethoxycarbonyl)-4,6,8,10-tetramethyl-13-oxo-2-propylhexadecanoic acid.

Molecular Properties

• Compound Name: 16-[2-[9-[(2R,3R,4R,5R,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-oxononoxy]ethoxy]-4-butoxycarbonyl-6-[2-(dimethylamino)ethoxycarbonyl]-2-[2-ethylsulfanylcarbothioylsulfanyl-2-methyl-3-oxo-3-[2-(pyridin-2-yldisulfanyl)ethoxy]propyl]-10-isocyano-8-(2-methoxyethoxycarbonyl)-4,6,8,10-tetramethyl-13-oxo-2-propylhexadecanoic acid;16-[2-[6-[2-[9-[(2R,3R,4R,5R,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-oxononoxy]ethoxy]-3-oxohexoxy]ethoxy]-4-butoxycarbonyl-6-[2-(dimethylamino)ethoxycarbonyl]-2-[2-ethylsulfanylcarbothioylsulfanyl-2-methyl-3-oxo-3-[2-(pyridin-2-yldisulfanyl)ethoxy]propyl]-10-isocyano-8-(2-methoxyethoxycarbonyl)-4,6,8,10-tetramethyl-13-oxo-2-propylhexadecanoic acid
• PubChem CID: 158123000
• Molecular Formula: C150H246N8O45S10
• Molecular Weight: 3202.30 g/mol
• Exact Mass: 3199.44
• IUPAC Name: 16-[2-[9-[(2R,3R,4R,5R,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-oxononoxy]ethoxy]-4-butoxycarbonyl-6-[2-(dimethylamino)ethoxycarbonyl]-2-[2-ethylsulfanylcarbothioylsulfanyl-2-methyl-3-oxo-3-[2-(pyridin-2-yldisulfanyl)ethoxy]propyl]-10-isocyano-8-(2-methoxyethoxycarbonyl)-4,6,8,10-tetramethyl-13-oxo-2-propylhexadecanoic acid;16-[2-[6-[2-[9-[(2R,3R,4R,5R,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-oxononoxy]ethoxy]-3-oxohexoxy]ethoxy]-4-butoxycarbonyl-6-[2-(dimethylamino)ethoxycarbonyl]-2-[2-ethylsulfanylcarbothioylsulfanyl-2-methyl-3-oxo-3-[2-(pyridin-2-yldisulfanyl)ethoxy]propyl]-10-isocyano-8-(2-methoxyethoxycarbonyl)-4,6,8,10-tetramethyl-13-oxo-2-propylhexadecanoic acid
• SMILES: [C-]#[N+]C(C)(CCC(=O)CCCOCCOCCC(=O)CCCCCCO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1NC(C)=O)CC(C)(CC(C)(CC(C)(CC(CCC)(CC(C)(SC(=S)SCC)C(=O)OCCSSc1ccccn1)C(=O)O)C(=O)OCCCC)C(=O)OCCN(C)C)C(=O)OCCOC.[C-]#[N+]C(C)(CCC(=O)CCCOCCOCCC(=O)CCCOCCOCCC(=O)CCCCCCO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1NC(C)=O)CC(C)(CC(C)(CC(C)(CC(CCC)(CC(C)(SC(=S)SCC)C(=O)OCCSSc1ccccn1)C(=O)O)C(=O)OCCCC)C(=O)OCCN(C)C)C(=O)OCCOC
• InChI: InChI=1S/C79H130N4O24S5.C71H116N4O21S5/c1-14-17-39-103-71(95)76(7,56-79(33-15-2,68(91)92)57-78(9,111-73(108)109-16-3)72(96)106-50-51-110-112-63-29-21-22-35-81-63)54-74(5,69(93)104-43-36-83(11)12)53-75(6,70(94)105-49-44-97-13)55-77(8,80-10)34-30-59(86)27-24-37-98-45-48-101-42-32-61(88)28-25-38-99-46-47-100-41-31-60(87)26-20-18-19-23-40-102-67-64(82-58(4)85)66(90)65(89)62(52-84)107-67;1-14-17-35-92-63(86)68(7,49-71(30-15-2,60(82)83)50-70(9,100-65(97)98-16-3)64(87)95-43-44-99-101-55-27-21-22-32-73-55)47-66(5,61(84)93-38-33-75(11)12)46-67(6,62(85)94-42-39-88-13)48-69(8,72-10)31-28-52(78)26-24-34-89-40-41-90-37-29-53(79)25-20-18-19-23-36-91-59-56(74-51(4)77)58(81)57(80)54(45-76)96-59/h21-22,29,35,62,64-67,84,89-90H,14-20,23-28,30-34,36-57H2,1-9,11-13H3,(H,82,85)(H,91,92);21-22,27,32,54,56-59,76,80-81H,14-20,23-26,28-31,33-50H2,1-9,11-13H3,(H,74,77)(H,82,83)/t62-,64-,65+,66-,67-,74?,75?,76?,77?,78?,79?;54-,56-,57+,58-,59-,66?,67?,68?,69?,70?,71?/m11/s1
• InChIKey: FRVCJNFRQMCCFF-BZQYFJBJSA-N
• XLogP: 20.94
• TPSA: 701.67 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 57
• Rotatable Bonds: 122
• Heavy Atoms: 213
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3202.30
LogP ≤ 5	20.94
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	57

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'disulphide', 'substructure': 'N/A'}, {'alert_name': 'Thiocarbonyl_group', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 16-[2-[9-[(2R,3R,4R,5R,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-oxononoxy]ethoxy]-4-butoxycarbonyl-6-[2-(dimethylamino)ethoxycarbonyl]-2-[2-ethylsulfanylcarbothioylsulfanyl-2-methyl-3-oxo-3-[2-(pyridin-2-yldisulfanyl)ethoxy]propyl]-10-isocyano-8-(2-methoxyethoxycarbonyl)-4,6,8,10-tetramethyl-13-oxo-2-propylhexadecanoic acid;16-[2-[6-[2-[9-[(2R,3R,4R,5R,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-oxononoxy]ethoxy]-3-oxohexoxy]ethoxy]-4-butoxycarbonyl-6-[2-(dimethylamino)ethoxycarbonyl]-2-[2-ethylsulfanylcarbothioylsulfanyl-2-methyl-3-oxo-3-[2-(pyridin-2-yldisulfanyl)ethoxy]propyl]-10-isocyano-8-(2-methoxyethoxycarbonyl)-4,6,8,10-tetramethyl-13-oxo-2-propylhexadecanoic acid?

The IUPAC name of 16-[2-[9-[(2R,3R,4R,5R,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-oxononoxy]ethoxy]-4-butoxycarbonyl-6-[2-(dimethylamino)ethoxycarbonyl]-2-[2-ethylsulfanylcarbothioylsulfanyl-2-methyl-3-oxo-3-[2-(pyridin-2-yldisulfanyl)ethoxy]propyl]-10-isocyano-8-(2-methoxyethoxycarbonyl)-4,6,8,10-tetramethyl-13-oxo-2-propylhexadecanoic acid;16-[2-[6-[2-[9-[(2R,3R,4R,5R,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-oxononoxy]ethoxy]-3-oxohexoxy]ethoxy]-4-butoxycarbonyl-6-[2-(dimethylamino)ethoxycarbonyl]-2-[2-ethylsulfanylcarbothioylsulfanyl-2-methyl-3-oxo-3-[2-(pyridin-2-yldisulfanyl)ethoxy]propyl]-10-isocyano-8-(2-methoxyethoxycarbonyl)-4,6,8,10-tetramethyl-13-oxo-2-propylhexadecanoic acid (CID 158123000) is 16-[2-[9-[(2R,3R,4R,5R,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-oxononoxy]ethoxy]-4-butoxycarbonyl-6-[2-(dimethylamino)ethoxycarbonyl]-2-[2-ethylsulfanylcarbothioylsulfanyl-2-methyl-3-oxo-3-[2-(pyridin-2-yldisulfanyl)ethoxy]propyl]-10-isocyano-8-(2-methoxyethoxycarbonyl)-4,6,8,10-tetramethyl-13-oxo-2-propylhexadecanoic acid;16-[2-[6-[2-[9-[(2R,3R,4R,5R,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-oxononoxy]ethoxy]-3-oxohexoxy]ethoxy]-4-butoxycarbonyl-6-[2-(dimethylamino)ethoxycarbonyl]-2-[2-ethylsulfanylcarbothioylsulfanyl-2-methyl-3-oxo-3-[2-(pyridin-2-yldisulfanyl)ethoxy]propyl]-10-isocyano-8-(2-methoxyethoxycarbonyl)-4,6,8,10-tetramethyl-13-oxo-2-propylhexadecanoic acid.

What is the SMILES notation for 16-[2-[9-[(2R,3R,4R,5R,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-oxononoxy]ethoxy]-4-butoxycarbonyl-6-[2-(dimethylamino)ethoxycarbonyl]-2-[2-ethylsulfanylcarbothioylsulfanyl-2-methyl-3-oxo-3-[2-(pyridin-2-yldisulfanyl)ethoxy]propyl]-10-isocyano-8-(2-methoxyethoxycarbonyl)-4,6,8,10-tetramethyl-13-oxo-2-propylhexadecanoic acid;16-[2-[6-[2-[9-[(2R,3R,4R,5R,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-oxononoxy]ethoxy]-3-oxohexoxy]ethoxy]-4-butoxycarbonyl-6-[2-(dimethylamino)ethoxycarbonyl]-2-[2-ethylsulfanylcarbothioylsulfanyl-2-methyl-3-oxo-3-[2-(pyridin-2-yldisulfanyl)ethoxy]propyl]-10-isocyano-8-(2-methoxyethoxycarbonyl)-4,6,8,10-tetramethyl-13-oxo-2-propylhexadecanoic acid?

The canonical SMILES for 16-[2-[9-[(2R,3R,4R,5R,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-oxononoxy]ethoxy]-4-butoxycarbonyl-6-[2-(dimethylamino)ethoxycarbonyl]-2-[2-ethylsulfanylcarbothioylsulfanyl-2-methyl-3-oxo-3-[2-(pyridin-2-yldisulfanyl)ethoxy]propyl]-10-isocyano-8-(2-methoxyethoxycarbonyl)-4,6,8,10-tetramethyl-13-oxo-2-propylhexadecanoic acid;16-[2-[6-[2-[9-[(2R,3R,4R,5R,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-oxononoxy]ethoxy]-3-oxohexoxy]ethoxy]-4-butoxycarbonyl-6-[2-(dimethylamino)ethoxycarbonyl]-2-[2-ethylsulfanylcarbothioylsulfanyl-2-methyl-3-oxo-3-[2-(pyridin-2-yldisulfanyl)ethoxy]propyl]-10-isocyano-8-(2-methoxyethoxycarbonyl)-4,6,8,10-tetramethyl-13-oxo-2-propylhexadecanoic acid is [C-]#[N+]C(C)(CCC(=O)CCCOCCOCCC(=O)CCCCCCO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1NC(C)=O)CC(C)(CC(C)(CC(C)(CC(CCC)(CC(C)(SC(=S)SCC)C(=O)OCCSSc1ccccn1)C(=O)O)C(=O)OCCCC)C(=O)OCCN(C)C)C(=O)OCCOC.[C-]#[N+]C(C)(CCC(=O)CCCOCCOCCC(=O)CCCOCCOCCC(=O)CCCCCCO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1NC(C)=O)CC(C)(CC(C)(CC(C)(CC(CCC)(CC(C)(SC(=S)SCC)C(=O)OCCSSc1ccccn1)C(=O)O)C(=O)OCCCC)C(=O)OCCN(C)C)C(=O)OCCOC.

What is the InChIKey of 16-[2-[9-[(2R,3R,4R,5R,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-oxononoxy]ethoxy]-4-butoxycarbonyl-6-[2-(dimethylamino)ethoxycarbonyl]-2-[2-ethylsulfanylcarbothioylsulfanyl-2-methyl-3-oxo-3-[2-(pyridin-2-yldisulfanyl)ethoxy]propyl]-10-isocyano-8-(2-methoxyethoxycarbonyl)-4,6,8,10-tetramethyl-13-oxo-2-propylhexadecanoic acid;16-[2-[6-[2-[9-[(2R,3R,4R,5R,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-oxononoxy]ethoxy]-3-oxohexoxy]ethoxy]-4-butoxycarbonyl-6-[2-(dimethylamino)ethoxycarbonyl]-2-[2-ethylsulfanylcarbothioylsulfanyl-2-methyl-3-oxo-3-[2-(pyridin-2-yldisulfanyl)ethoxy]propyl]-10-isocyano-8-(2-methoxyethoxycarbonyl)-4,6,8,10-tetramethyl-13-oxo-2-propylhexadecanoic acid?

The InChIKey is FRVCJNFRQMCCFF-BZQYFJBJSA-N. The full InChI is InChI=1S/C79H130N4O24S5.C71H116N4O21S5/c1-14-17-39-103-71(95)76(7,56-79(33-15-2,68(91)92)57-78(9,111-73(108)109-16-3)72(96)106-50-51-110-112-63-29-21-22-35-81-63)54-74(5,69(93)104-43-36-83(11)12)53-75(6,70(94)105-49-44-97-13)55-77(8,80-10)34-30-59(86)27-24-37-98-45-48-101-42-32-61(88)28-25-38-99-46-47-100-41-31-60(87)26-20-18-19-23-40-102-67-64(82-58(4)85)66(90)65(89)62(52-84)107-67;1-14-17-35-92-63(86)68(7,49-71(30-15-2,60(82)83)50-70(9,100-65(97)98-16-3)64(87)95-43-44-99-101-55-27-21-22-32-73-55)47-66(5,61(84)93-38-33-75(11)12)46-67(6,62(85)94-42-39-88-13)48-69(8,72-10)31-28-52(78)26-24-34-89-40-41-90-37-29-53(79)25-20-18-19-23-36-91-59-56(74-51(4)77)58(81)57(80)54(45-76)96-59/h21-22,29,35,62,64-67,84,89-90H,14-20,23-28,30-34,36-57H2,1-9,11-13H3,(H,82,85)(H,91,92);21-22,27,32,54,56-59,76,80-81H,14-20,23-26,28-31,33-50H2,1-9,11-13H3,(H,74,77)(H,82,83)/t62-,64-,65+,66-,67-,74?,75?,76?,77?,78?,79?;54-,56-,57+,58-,59-,66?,67?,68?,69?,70?,71?/m11/s1.

What are the key properties of 16-[2-[9-[(2R,3R,4R,5R,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-oxononoxy]ethoxy]-4-butoxycarbonyl-6-[2-(dimethylamino)ethoxycarbonyl]-2-[2-ethylsulfanylcarbothioylsulfanyl-2-methyl-3-oxo-3-[2-(pyridin-2-yldisulfanyl)ethoxy]propyl]-10-isocyano-8-(2-methoxyethoxycarbonyl)-4,6,8,10-tetramethyl-13-oxo-2-propylhexadecanoic acid;16-[2-[6-[2-[9-[(2R,3R,4R,5R,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-oxononoxy]ethoxy]-3-oxohexoxy]ethoxy]-4-butoxycarbonyl-6-[2-(dimethylamino)ethoxycarbonyl]-2-[2-ethylsulfanylcarbothioylsulfanyl-2-methyl-3-oxo-3-[2-(pyridin-2-yldisulfanyl)ethoxy]propyl]-10-isocyano-8-(2-methoxyethoxycarbonyl)-4,6,8,10-tetramethyl-13-oxo-2-propylhexadecanoic acid?

16-[2-[9-[(2R,3R,4R,5R,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-oxononoxy]ethoxy]-4-butoxycarbonyl-6-[2-(dimethylamino)ethoxycarbonyl]-2-[2-ethylsulfanylcarbothioylsulfanyl-2-methyl-3-oxo-3-[2-(pyridin-2-yldisulfanyl)ethoxy]propyl]-10-isocyano-8-(2-methoxyethoxycarbonyl)-4,6,8,10-tetramethyl-13-oxo-2-propylhexadecanoic acid;16-[2-[6-[2-[9-[(2R,3R,4R,5R,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-oxononoxy]ethoxy]-3-oxohexoxy]ethoxy]-4-butoxycarbonyl-6-[2-(dimethylamino)ethoxycarbonyl]-2-[2-ethylsulfanylcarbothioylsulfanyl-2-methyl-3-oxo-3-[2-(pyridin-2-yldisulfanyl)ethoxy]propyl]-10-isocyano-8-(2-methoxyethoxycarbonyl)-4,6,8,10-tetramethyl-13-oxo-2-propylhexadecanoic acid has a molecular weight of 3202.30 g/mol, XLogP of 20.94, 122 rotatable bonds, 10 hydrogen bond donors, and 57 hydrogen bond acceptors.

Where does this data come from?

All data for 16-[2-[9-[(2R,3R,4R,5R,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-oxononoxy]ethoxy]-4-butoxycarbonyl-6-[2-(dimethylamino)ethoxycarbonyl]-2-[2-ethylsulfanylcarbothioylsulfanyl-2-methyl-3-oxo-3-[2-(pyridin-2-yldisulfanyl)ethoxy]propyl]-10-isocyano-8-(2-methoxyethoxycarbonyl)-4,6,8,10-tetramethyl-13-oxo-2-propylhexadecanoic acid;16-[2-[6-[2-[9-[(2R,3R,4R,5R,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-oxononoxy]ethoxy]-3-oxohexoxy]ethoxy]-4-butoxycarbonyl-6-[2-(dimethylamino)ethoxycarbonyl]-2-[2-ethylsulfanylcarbothioylsulfanyl-2-methyl-3-oxo-3-[2-(pyridin-2-yldisulfanyl)ethoxy]propyl]-10-isocyano-8-(2-methoxyethoxycarbonyl)-4,6,8,10-tetramethyl-13-oxo-2-propylhexadecanoic acid is sourced from PubChem (CID 158123000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).