About [(4R)-4-hydroxy-1-(4-methylpentanoyl)pyrrolidin-2-yl]methyl [(5S)-5-(propan-2-yloxymethyl)-1-(4-propan-2-ylsulfanylbutanoyl)pyrrolidin-3-yl] hydrogen phosphate;[(2S,4R)-4-hydroxy-1-[4-oxo-7-(propan-2-ylamino)heptanoyl]pyrrolidin-2-yl]methyl [(5S)-1-[4-(propan-2-ylamino)butanoyl]-5-(propan-2-yloxymethyl)pyrrolidin-3-yl] hydrogen phosphate;4-methyl-1-[[2-oxo-2-[(2S,4R)-4-propan-2-yloxy-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]ethyl]disulfanyl]pentan-3-one;14-methyl-1-[(2S,4R)-4-propan-2-yloxy-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]pentadecane-1,4-dione;4-methyl-1-[(2S,4R)-4-propan-2-yloxy-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]pentan-1-one;2-(propan-2-yldisulfanyl)-1-[(2S,4R)-4-propan-2-yloxy-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]ethanone
[(4R)-4-hydroxy-1-(4-methylpentanoyl)pyrrolidin-2-yl]methyl [(5S)-5-(propan-2-yloxymethyl)-1-(4-propan-2-ylsulfanylbutanoyl)pyrrolidin-3-yl] hydrogen phosphate;[(2S,4R)-4-hydroxy-1-[4-oxo-7-(propan-2-ylamino)heptanoyl]pyrrolidin-2-yl]methyl [(5S)-1-[4-(propan-2-ylamino)butanoyl]-5-(propan-2-yloxymethyl)pyrrolidin-3-yl] hydrogen phosphate;4-methyl-1-[[2-oxo-2-[(2S,4R)-4-propan-2-yloxy-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]ethyl]disulfanyl]pentan-3-one;14-methyl-1-[(2S,4R)-4-propan-2-yloxy-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]pentadecane-1,4-dione;4-methyl-1-[(2S,4R)-4-propan-2-yloxy-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]pentan-1-one;2-(propan-2-yldisulfanyl)-1-[(2S,4R)-4-propan-2-yloxy-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]ethanone (PubChem CID 158501808) has the molecular formula C135H256N10O31P2S5
and a molecular weight of 2737.85 g/mol. Its IUPAC name is [(4R)-4-hydroxy-1-(4-methylpentanoyl)pyrrolidin-2-yl]methyl [(5S)-5-(propan-2-yloxymethyl)-1-(4-propan-2-ylsulfanylbutanoyl)pyrrolidin-3-yl] hydrogen phosphate;[(2S,4R)-4-hydroxy-1-[4-oxo-7-(propan-2-ylamino)heptanoyl]pyrrolidin-2-yl]methyl [(5S)-1-[4-(propan-2-ylamino)butanoyl]-5-(propan-2-yloxymethyl)pyrrolidin-3-yl] hydrogen phosphate;4-methyl-1-[[2-oxo-2-[(2S,4R)-4-propan-2-yloxy-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]ethyl]disulfanyl]pentan-3-one;14-methyl-1-[(2S,4R)-4-propan-2-yloxy-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]pentadecane-1,4-dione;4-methyl-1-[(2S,4R)-4-propan-2-yloxy-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]pentan-1-one;2-(propan-2-yldisulfanyl)-1-[(2S,4R)-4-propan-2-yloxy-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]ethanone.
Frequently Asked Questions
What is the IUPAC name of [(4R)-4-hydroxy-1-(4-methylpentanoyl)pyrrolidin-2-yl]methyl [(5S)-5-(propan-2-yloxymethyl)-1-(4-propan-2-ylsulfanylbutanoyl)pyrrolidin-3-yl] hydrogen phosphate;[(2S,4R)-4-hydroxy-1-[4-oxo-7-(propan-2-ylamino)heptanoyl]pyrrolidin-2-yl]methyl [(5S)-1-[4-(propan-2-ylamino)butanoyl]-5-(propan-2-yloxymethyl)pyrrolidin-3-yl] hydrogen phosphate;4-methyl-1-[[2-oxo-2-[(2S,4R)-4-propan-2-yloxy-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]ethyl]disulfanyl]pentan-3-one;14-methyl-1-[(2S,4R)-4-propan-2-yloxy-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]pentadecane-1,4-dione;4-methyl-1-[(2S,4R)-4-propan-2-yloxy-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]pentan-1-one;2-(propan-2-yldisulfanyl)-1-[(2S,4R)-4-propan-2-yloxy-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]ethanone?
The IUPAC name of [(4R)-4-hydroxy-1-(4-methylpentanoyl)pyrrolidin-2-yl]methyl [(5S)-5-(propan-2-yloxymethyl)-1-(4-propan-2-ylsulfanylbutanoyl)pyrrolidin-3-yl] hydrogen phosphate;[(2S,4R)-4-hydroxy-1-[4-oxo-7-(propan-2-ylamino)heptanoyl]pyrrolidin-2-yl]methyl [(5S)-1-[4-(propan-2-ylamino)butanoyl]-5-(propan-2-yloxymethyl)pyrrolidin-3-yl] hydrogen phosphate;4-methyl-1-[[2-oxo-2-[(2S,4R)-4-propan-2-yloxy-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]ethyl]disulfanyl]pentan-3-one;14-methyl-1-[(2S,4R)-4-propan-2-yloxy-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]pentadecane-1,4-dione;4-methyl-1-[(2S,4R)-4-propan-2-yloxy-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]pentan-1-one;2-(propan-2-yldisulfanyl)-1-[(2S,4R)-4-propan-2-yloxy-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]ethanone (CID 158501808) is [(4R)-4-hydroxy-1-(4-methylpentanoyl)pyrrolidin-2-yl]methyl [(5S)-5-(propan-2-yloxymethyl)-1-(4-propan-2-ylsulfanylbutanoyl)pyrrolidin-3-yl] hydrogen phosphate;[(2S,4R)-4-hydroxy-1-[4-oxo-7-(propan-2-ylamino)heptanoyl]pyrrolidin-2-yl]methyl [(5S)-1-[4-(propan-2-ylamino)butanoyl]-5-(propan-2-yloxymethyl)pyrrolidin-3-yl] hydrogen phosphate;4-methyl-1-[[2-oxo-2-[(2S,4R)-4-propan-2-yloxy-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]ethyl]disulfanyl]pentan-3-one;14-methyl-1-[(2S,4R)-4-propan-2-yloxy-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]pentadecane-1,4-dione;4-methyl-1-[(2S,4R)-4-propan-2-yloxy-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]pentan-1-one;2-(propan-2-yldisulfanyl)-1-[(2S,4R)-4-propan-2-yloxy-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]ethanone.
What is the SMILES notation for [(4R)-4-hydroxy-1-(4-methylpentanoyl)pyrrolidin-2-yl]methyl [(5S)-5-(propan-2-yloxymethyl)-1-(4-propan-2-ylsulfanylbutanoyl)pyrrolidin-3-yl] hydrogen phosphate;[(2S,4R)-4-hydroxy-1-[4-oxo-7-(propan-2-ylamino)heptanoyl]pyrrolidin-2-yl]methyl [(5S)-1-[4-(propan-2-ylamino)butanoyl]-5-(propan-2-yloxymethyl)pyrrolidin-3-yl] hydrogen phosphate;4-methyl-1-[[2-oxo-2-[(2S,4R)-4-propan-2-yloxy-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]ethyl]disulfanyl]pentan-3-one;14-methyl-1-[(2S,4R)-4-propan-2-yloxy-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]pentadecane-1,4-dione;4-methyl-1-[(2S,4R)-4-propan-2-yloxy-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]pentan-1-one;2-(propan-2-yldisulfanyl)-1-[(2S,4R)-4-propan-2-yloxy-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]ethanone?
The canonical SMILES for [(4R)-4-hydroxy-1-(4-methylpentanoyl)pyrrolidin-2-yl]methyl [(5S)-5-(propan-2-yloxymethyl)-1-(4-propan-2-ylsulfanylbutanoyl)pyrrolidin-3-yl] hydrogen phosphate;[(2S,4R)-4-hydroxy-1-[4-oxo-7-(propan-2-ylamino)heptanoyl]pyrrolidin-2-yl]methyl [(5S)-1-[4-(propan-2-ylamino)butanoyl]-5-(propan-2-yloxymethyl)pyrrolidin-3-yl] hydrogen phosphate;4-methyl-1-[[2-oxo-2-[(2S,4R)-4-propan-2-yloxy-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]ethyl]disulfanyl]pentan-3-one;14-methyl-1-[(2S,4R)-4-propan-2-yloxy-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]pentadecane-1,4-dione;4-methyl-1-[(2S,4R)-4-propan-2-yloxy-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]pentan-1-one;2-(propan-2-yldisulfanyl)-1-[(2S,4R)-4-propan-2-yloxy-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]ethanone is CC(C)CCC(=O)N1C[C@H](O)CC1COP(=O)(O)OC1C[C@@H](COC(C)C)N(C(=O)CCCSC(C)C)C1.CC(C)CCC(=O)N1C[C@H](OC(C)C)C[C@H]1COC(C)C.CC(C)CCCCCCCCCC(=O)CCC(=O)N1C[C@H](OC(C)C)C[C@H]1COC(C)C.CC(C)NCCCC(=O)CCC(=O)N1C[C@H](O)C[C@H]1COP(=O)(O)OC1C[C@@H](COC(C)C)N(C(=O)CCCNC(C)C)C1.CC(C)OC[C@@H]1C[C@@H](OC(C)C)CN1C(=O)CSSC(C)C.CC(C)OC[C@@H]1C[C@@H](OC(C)C)CN1C(=O)CSSCCC(=O)C(C)C.
What is the InChIKey of [(4R)-4-hydroxy-1-(4-methylpentanoyl)pyrrolidin-2-yl]methyl [(5S)-5-(propan-2-yloxymethyl)-1-(4-propan-2-ylsulfanylbutanoyl)pyrrolidin-3-yl] hydrogen phosphate;[(2S,4R)-4-hydroxy-1-[4-oxo-7-(propan-2-ylamino)heptanoyl]pyrrolidin-2-yl]methyl [(5S)-1-[4-(propan-2-ylamino)butanoyl]-5-(propan-2-yloxymethyl)pyrrolidin-3-yl] hydrogen phosphate;4-methyl-1-[[2-oxo-2-[(2S,4R)-4-propan-2-yloxy-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]ethyl]disulfanyl]pentan-3-one;14-methyl-1-[(2S,4R)-4-propan-2-yloxy-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]pentadecane-1,4-dione;4-methyl-1-[(2S,4R)-4-propan-2-yloxy-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]pentan-1-one;2-(propan-2-yldisulfanyl)-1-[(2S,4R)-4-propan-2-yloxy-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]ethanone?
The InChIKey is HJZGFAUJAAMTBV-KLHRDGSDSA-N. The full InChI is InChI=1S/C30H57N4O9P.C27H51NO4.C26H49N2O8PS.C19H35NO4S2.C17H33NO3.C16H31NO3S2/c1-21(2)31-13-7-9-26(35)11-12-30(38)33-17-27(36)15-24(33)20-42-44(39,40)43-28-16-25(19-41-23(5)6)34(18-28)29(37)10-8-14-32-22(3)4;1-21(2)14-12-10-8-7-9-11-13-15-25(29)16-17-27(30)28-19-26(32-23(5)6)18-24(28)20-31-22(3)4;1-18(2)9-10-26(31)27-14-23(29)12-21(27)17-35-37(32,33)36-24-13-22(16-34-19(3)4)28(15-24)25(30)8-7-11-38-20(5)6;1-13(2)18(21)7-8-25-26-12-19(22)20-10-17(24-15(5)6)9-16(20)11-23-14(3)4;1-12(2)7-8-17(19)18-10-16(21-14(5)6)9-15(18)11-20-13(3)4;1-11(2)19-9-14-7-15(20-12(3)4)8-17(14)16(18)10-21-22-13(5)6/h21-25,27-28,31-32,36H,7-20H2,1-6H3,(H,39,40);21-24,26H,7-20H2,1-6H3;18-24,29H,7-17H2,1-6H3,(H,32,33);13-17H,7-12H2,1-6H3;12-16H,7-11H2,1-6H3;11-15H,7-10H2,1-6H3/t24-,25-,27+,28?;24-,26+;21?,22-,23+,24?;16-,17+;15-,16+;14-,15+/m000000/s1.
What are the key properties of [(4R)-4-hydroxy-1-(4-methylpentanoyl)pyrrolidin-2-yl]methyl [(5S)-5-(propan-2-yloxymethyl)-1-(4-propan-2-ylsulfanylbutanoyl)pyrrolidin-3-yl] hydrogen phosphate;[(2S,4R)-4-hydroxy-1-[4-oxo-7-(propan-2-ylamino)heptanoyl]pyrrolidin-2-yl]methyl [(5S)-1-[4-(propan-2-ylamino)butanoyl]-5-(propan-2-yloxymethyl)pyrrolidin-3-yl] hydrogen phosphate;4-methyl-1-[[2-oxo-2-[(2S,4R)-4-propan-2-yloxy-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]ethyl]disulfanyl]pentan-3-one;14-methyl-1-[(2S,4R)-4-propan-2-yloxy-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]pentadecane-1,4-dione;4-methyl-1-[(2S,4R)-4-propan-2-yloxy-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]pentan-1-one;2-(propan-2-yldisulfanyl)-1-[(2S,4R)-4-propan-2-yloxy-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]ethanone?
[(4R)-4-hydroxy-1-(4-methylpentanoyl)pyrrolidin-2-yl]methyl [(5S)-5-(propan-2-yloxymethyl)-1-(4-propan-2-ylsulfanylbutanoyl)pyrrolidin-3-yl] hydrogen phosphate;[(2S,4R)-4-hydroxy-1-[4-oxo-7-(propan-2-ylamino)heptanoyl]pyrrolidin-2-yl]methyl [(5S)-1-[4-(propan-2-ylamino)butanoyl]-5-(propan-2-yloxymethyl)pyrrolidin-3-yl] hydrogen phosphate;4-methyl-1-[[2-oxo-2-[(2S,4R)-4-propan-2-yloxy-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]ethyl]disulfanyl]pentan-3-one;14-methyl-1-[(2S,4R)-4-propan-2-yloxy-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]pentadecane-1,4-dione;4-methyl-1-[(2S,4R)-4-propan-2-yloxy-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]pentan-1-one;2-(propan-2-yldisulfanyl)-1-[(2S,4R)-4-propan-2-yloxy-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]ethanone has a molecular weight of 2737.85 g/mol, XLogP of 23.18, 84 rotatable bonds, 6 hydrogen bond donors, and 36 hydrogen bond acceptors.
Where does this data come from?
All data for [(4R)-4-hydroxy-1-(4-methylpentanoyl)pyrrolidin-2-yl]methyl [(5S)-5-(propan-2-yloxymethyl)-1-(4-propan-2-ylsulfanylbutanoyl)pyrrolidin-3-yl] hydrogen phosphate;[(2S,4R)-4-hydroxy-1-[4-oxo-7-(propan-2-ylamino)heptanoyl]pyrrolidin-2-yl]methyl [(5S)-1-[4-(propan-2-ylamino)butanoyl]-5-(propan-2-yloxymethyl)pyrrolidin-3-yl] hydrogen phosphate;4-methyl-1-[[2-oxo-2-[(2S,4R)-4-propan-2-yloxy-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]ethyl]disulfanyl]pentan-3-one;14-methyl-1-[(2S,4R)-4-propan-2-yloxy-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]pentadecane-1,4-dione;4-methyl-1-[(2S,4R)-4-propan-2-yloxy-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]pentan-1-one;2-(propan-2-yldisulfanyl)-1-[(2S,4R)-4-propan-2-yloxy-2-(propan-2-yloxymethyl)pyrrolidin-1-yl]ethanone is sourced from PubChem (CID 158501808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).