About (4R,6E,10E,12Z)-16,18-bis[[tert-butyl(dimethyl)silyl]oxy]-15-chloro-4-methyl-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(14),6,10,15,17-pentaen-2-one;(4R,6E,10E,12E)-16,18-bis[[tert-butyl(dimethyl)silyl]oxy]-15-chloro-4-methyl-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(14),6,10,15,17-pentaen-2-one;(4R,6E,10E)-15-chloro-16,18-dihydroxy-4-methyl-12-(phenylmethoxyamino)-3-oxabicyclo[12.4.0]octadeca-1(14),6,10,15,17-pentaen-2-one;(4R,6E,10E,12E)-15-chloro-16,18-dihydroxy-4-methyl-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(14),6,10,15,17-pentaen-2-one;(4R,6E,10E,12Z)-16,18-dihydroxy-4-methyl-15-(oxan-2-yl)-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(18),6,10,14,16-pentaen-2-one;(4R,6E,10E,12E)-16,18-dihydroxy-4-methyl-15-(oxan-2-yl)-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(18),6,10,14,16-pentaen-2-one
(4R,6E,10E,12Z)-16,18-bis[[tert-butyl(dimethyl)silyl]oxy]-15-chloro-4-methyl-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(14),6,10,15,17-pentaen-2-one;(4R,6E,10E,12E)-16,18-bis[[tert-butyl(dimethyl)silyl]oxy]-15-chloro-4-methyl-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(14),6,10,15,17-pentaen-2-one;(4R,6E,10E)-15-chloro-16,18-dihydroxy-4-methyl-12-(phenylmethoxyamino)-3-oxabicyclo[12.4.0]octadeca-1(14),6,10,15,17-pentaen-2-one;(4R,6E,10E,12E)-15-chloro-16,18-dihydroxy-4-methyl-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(14),6,10,15,17-pentaen-2-one;(4R,6E,10E,12Z)-16,18-dihydroxy-4-methyl-15-(oxan-2-yl)-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(18),6,10,14,16-pentaen-2-one;(4R,6E,10E,12E)-16,18-dihydroxy-4-methyl-15-(oxan-2-yl)-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(18),6,10,14,16-pentaen-2-one (PubChem CID 172963149) has the molecular formula C184H232Cl4N6O32Si4
and a molecular weight of 3294.05 g/mol. Its IUPAC name is (4R,6E,10E,12Z)-16,18-bis[[tert-butyl(dimethyl)silyl]oxy]-15-chloro-4-methyl-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(14),6,10,15,17-pentaen-2-one;(4R,6E,10E,12E)-16,18-bis[[tert-butyl(dimethyl)silyl]oxy]-15-chloro-4-methyl-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(14),6,10,15,17-pentaen-2-one;(4R,6E,10E)-15-chloro-16,18-dihydroxy-4-methyl-12-(phenylmethoxyamino)-3-oxabicyclo[12.4.0]octadeca-1(14),6,10,15,17-pentaen-2-one;(4R,6E,10E,12E)-15-chloro-16,18-dihydroxy-4-methyl-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(14),6,10,15,17-pentaen-2-one;(4R,6E,10E,12Z)-16,18-dihydroxy-4-methyl-15-(oxan-2-yl)-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(18),6,10,14,16-pentaen-2-one;(4R,6E,10E,12E)-16,18-dihydroxy-4-methyl-15-(oxan-2-yl)-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(18),6,10,14,16-pentaen-2-one.
Frequently Asked Questions
What is the IUPAC name of (4R,6E,10E,12Z)-16,18-bis[[tert-butyl(dimethyl)silyl]oxy]-15-chloro-4-methyl-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(14),6,10,15,17-pentaen-2-one;(4R,6E,10E,12E)-16,18-bis[[tert-butyl(dimethyl)silyl]oxy]-15-chloro-4-methyl-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(14),6,10,15,17-pentaen-2-one;(4R,6E,10E)-15-chloro-16,18-dihydroxy-4-methyl-12-(phenylmethoxyamino)-3-oxabicyclo[12.4.0]octadeca-1(14),6,10,15,17-pentaen-2-one;(4R,6E,10E,12E)-15-chloro-16,18-dihydroxy-4-methyl-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(14),6,10,15,17-pentaen-2-one;(4R,6E,10E,12Z)-16,18-dihydroxy-4-methyl-15-(oxan-2-yl)-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(18),6,10,14,16-pentaen-2-one;(4R,6E,10E,12E)-16,18-dihydroxy-4-methyl-15-(oxan-2-yl)-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(18),6,10,14,16-pentaen-2-one?
The IUPAC name of (4R,6E,10E,12Z)-16,18-bis[[tert-butyl(dimethyl)silyl]oxy]-15-chloro-4-methyl-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(14),6,10,15,17-pentaen-2-one;(4R,6E,10E,12E)-16,18-bis[[tert-butyl(dimethyl)silyl]oxy]-15-chloro-4-methyl-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(14),6,10,15,17-pentaen-2-one;(4R,6E,10E)-15-chloro-16,18-dihydroxy-4-methyl-12-(phenylmethoxyamino)-3-oxabicyclo[12.4.0]octadeca-1(14),6,10,15,17-pentaen-2-one;(4R,6E,10E,12E)-15-chloro-16,18-dihydroxy-4-methyl-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(14),6,10,15,17-pentaen-2-one;(4R,6E,10E,12Z)-16,18-dihydroxy-4-methyl-15-(oxan-2-yl)-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(18),6,10,14,16-pentaen-2-one;(4R,6E,10E,12E)-16,18-dihydroxy-4-methyl-15-(oxan-2-yl)-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(18),6,10,14,16-pentaen-2-one (CID 172963149) is (4R,6E,10E,12Z)-16,18-bis[[tert-butyl(dimethyl)silyl]oxy]-15-chloro-4-methyl-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(14),6,10,15,17-pentaen-2-one;(4R,6E,10E,12E)-16,18-bis[[tert-butyl(dimethyl)silyl]oxy]-15-chloro-4-methyl-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(14),6,10,15,17-pentaen-2-one;(4R,6E,10E)-15-chloro-16,18-dihydroxy-4-methyl-12-(phenylmethoxyamino)-3-oxabicyclo[12.4.0]octadeca-1(14),6,10,15,17-pentaen-2-one;(4R,6E,10E,12E)-15-chloro-16,18-dihydroxy-4-methyl-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(14),6,10,15,17-pentaen-2-one;(4R,6E,10E,12Z)-16,18-dihydroxy-4-methyl-15-(oxan-2-yl)-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(18),6,10,14,16-pentaen-2-one;(4R,6E,10E,12E)-16,18-dihydroxy-4-methyl-15-(oxan-2-yl)-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(18),6,10,14,16-pentaen-2-one.
What is the SMILES notation for (4R,6E,10E,12Z)-16,18-bis[[tert-butyl(dimethyl)silyl]oxy]-15-chloro-4-methyl-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(14),6,10,15,17-pentaen-2-one;(4R,6E,10E,12E)-16,18-bis[[tert-butyl(dimethyl)silyl]oxy]-15-chloro-4-methyl-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(14),6,10,15,17-pentaen-2-one;(4R,6E,10E)-15-chloro-16,18-dihydroxy-4-methyl-12-(phenylmethoxyamino)-3-oxabicyclo[12.4.0]octadeca-1(14),6,10,15,17-pentaen-2-one;(4R,6E,10E,12E)-15-chloro-16,18-dihydroxy-4-methyl-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(14),6,10,15,17-pentaen-2-one;(4R,6E,10E,12Z)-16,18-dihydroxy-4-methyl-15-(oxan-2-yl)-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(18),6,10,14,16-pentaen-2-one;(4R,6E,10E,12E)-16,18-dihydroxy-4-methyl-15-(oxan-2-yl)-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(18),6,10,14,16-pentaen-2-one?
The canonical SMILES for (4R,6E,10E,12Z)-16,18-bis[[tert-butyl(dimethyl)silyl]oxy]-15-chloro-4-methyl-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(14),6,10,15,17-pentaen-2-one;(4R,6E,10E,12E)-16,18-bis[[tert-butyl(dimethyl)silyl]oxy]-15-chloro-4-methyl-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(14),6,10,15,17-pentaen-2-one;(4R,6E,10E)-15-chloro-16,18-dihydroxy-4-methyl-12-(phenylmethoxyamino)-3-oxabicyclo[12.4.0]octadeca-1(14),6,10,15,17-pentaen-2-one;(4R,6E,10E,12E)-15-chloro-16,18-dihydroxy-4-methyl-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(14),6,10,15,17-pentaen-2-one;(4R,6E,10E,12Z)-16,18-dihydroxy-4-methyl-15-(oxan-2-yl)-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(18),6,10,14,16-pentaen-2-one;(4R,6E,10E,12E)-16,18-dihydroxy-4-methyl-15-(oxan-2-yl)-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(18),6,10,14,16-pentaen-2-one is C[C@@H]1C/C=C/CC/C=C/C(=N/OCc2ccccc2)Cc2c(Cl)c(O)cc(O)c2C(=O)O1.C[C@@H]1C/C=C/CC/C=C/C(=N/OCc2ccccc2)Cc2c(Cl)c(O[Si](C)(C)C(C)(C)C)cc(O[Si](C)(C)C(C)(C)C)c2C(=O)O1.C[C@@H]1C/C=C/CC/C=C/C(=N/OCc2ccccc2)Cc2c(c(O)cc(O)c2C2CCCCO2)C(=O)O1.C[C@@H]1C/C=C/CC/C=C/C(=N\OCc2ccccc2)Cc2c(Cl)c(O[Si](C)(C)C(C)(C)C)cc(O[Si](C)(C)C(C)(C)C)c2C(=O)O1.C[C@@H]1C/C=C/CC/C=C/C(=N\OCc2ccccc2)Cc2c(c(O)cc(O)c2C2CCCCO2)C(=O)O1.C[C@@H]1C/C=C/CC/C=C/C(NOCc2ccccc2)Cc2c(Cl)c(O)cc(O)c2C(=O)O1.
What is the InChIKey of (4R,6E,10E,12Z)-16,18-bis[[tert-butyl(dimethyl)silyl]oxy]-15-chloro-4-methyl-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(14),6,10,15,17-pentaen-2-one;(4R,6E,10E,12E)-16,18-bis[[tert-butyl(dimethyl)silyl]oxy]-15-chloro-4-methyl-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(14),6,10,15,17-pentaen-2-one;(4R,6E,10E)-15-chloro-16,18-dihydroxy-4-methyl-12-(phenylmethoxyamino)-3-oxabicyclo[12.4.0]octadeca-1(14),6,10,15,17-pentaen-2-one;(4R,6E,10E,12E)-15-chloro-16,18-dihydroxy-4-methyl-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(14),6,10,15,17-pentaen-2-one;(4R,6E,10E,12Z)-16,18-dihydroxy-4-methyl-15-(oxan-2-yl)-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(18),6,10,14,16-pentaen-2-one;(4R,6E,10E,12E)-16,18-dihydroxy-4-methyl-15-(oxan-2-yl)-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(18),6,10,14,16-pentaen-2-one?
The InChIKey is LAKRDZHQTCTCTJ-XCTSSJPKSA-N. The full InChI is InChI=1S/2C37H54ClNO5Si2.2C30H35NO6.C25H28ClNO5.C25H26ClNO5/c2*1-27-20-16-13-12-14-19-23-29(39-41-26-28-21-17-15-18-22-28)24-30-33(35(40)42-27)31(43-45(8,9)36(2,3)4)25-32(34(30)38)44-46(10,11)37(5,6)7;2*1-21-12-6-3-2-4-9-15-23(31-36-20-22-13-7-5-8-14-22)18-24-28(27-16-10-11-17-35-27)25(32)19-26(33)29(24)30(34)37-21;2*1-17-10-6-3-2-4-9-13-19(27-31-16-18-11-7-5-8-12-18)14-20-23(25(30)32-17)21(28)15-22(29)24(20)26/h2*13,15-19,21-23,25,27H,12,14,20,24,26H2,1-11H3;2*3,5-9,13-15,19,21,27,32-33H,2,4,10-12,16-18,20H2,1H3;3,5-9,11-13,15,17,19,27-29H,2,4,10,14,16H2,1H3;3,5-9,11-13,15,17,28-29H,2,4,10,14,16H2,1H3/b16-13+,23-19+,39-29+;16-13+,23-19+,39-29-;6-3+,15-9+,31-23+;6-3+,15-9+,31-23-;6-3+,13-9+;6-3+,13-9+,27-19-/t2*27-;2*21-,27?;17-,19?;17-/m111111/s1.
What are the key properties of (4R,6E,10E,12Z)-16,18-bis[[tert-butyl(dimethyl)silyl]oxy]-15-chloro-4-methyl-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(14),6,10,15,17-pentaen-2-one;(4R,6E,10E,12E)-16,18-bis[[tert-butyl(dimethyl)silyl]oxy]-15-chloro-4-methyl-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(14),6,10,15,17-pentaen-2-one;(4R,6E,10E)-15-chloro-16,18-dihydroxy-4-methyl-12-(phenylmethoxyamino)-3-oxabicyclo[12.4.0]octadeca-1(14),6,10,15,17-pentaen-2-one;(4R,6E,10E,12E)-15-chloro-16,18-dihydroxy-4-methyl-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(14),6,10,15,17-pentaen-2-one;(4R,6E,10E,12Z)-16,18-dihydroxy-4-methyl-15-(oxan-2-yl)-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(18),6,10,14,16-pentaen-2-one;(4R,6E,10E,12E)-16,18-dihydroxy-4-methyl-15-(oxan-2-yl)-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(18),6,10,14,16-pentaen-2-one?
(4R,6E,10E,12Z)-16,18-bis[[tert-butyl(dimethyl)silyl]oxy]-15-chloro-4-methyl-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(14),6,10,15,17-pentaen-2-one;(4R,6E,10E,12E)-16,18-bis[[tert-butyl(dimethyl)silyl]oxy]-15-chloro-4-methyl-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(14),6,10,15,17-pentaen-2-one;(4R,6E,10E)-15-chloro-16,18-dihydroxy-4-methyl-12-(phenylmethoxyamino)-3-oxabicyclo[12.4.0]octadeca-1(14),6,10,15,17-pentaen-2-one;(4R,6E,10E,12E)-15-chloro-16,18-dihydroxy-4-methyl-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(14),6,10,15,17-pentaen-2-one;(4R,6E,10E,12Z)-16,18-dihydroxy-4-methyl-15-(oxan-2-yl)-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(18),6,10,14,16-pentaen-2-one;(4R,6E,10E,12E)-16,18-dihydroxy-4-methyl-15-(oxan-2-yl)-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(18),6,10,14,16-pentaen-2-one has a molecular weight of 3294.05 g/mol, XLogP of 45.66, 29 rotatable bonds, 9 hydrogen bond donors, and 38 hydrogen bond acceptors.
Where does this data come from?
All data for (4R,6E,10E,12Z)-16,18-bis[[tert-butyl(dimethyl)silyl]oxy]-15-chloro-4-methyl-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(14),6,10,15,17-pentaen-2-one;(4R,6E,10E,12E)-16,18-bis[[tert-butyl(dimethyl)silyl]oxy]-15-chloro-4-methyl-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(14),6,10,15,17-pentaen-2-one;(4R,6E,10E)-15-chloro-16,18-dihydroxy-4-methyl-12-(phenylmethoxyamino)-3-oxabicyclo[12.4.0]octadeca-1(14),6,10,15,17-pentaen-2-one;(4R,6E,10E,12E)-15-chloro-16,18-dihydroxy-4-methyl-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(14),6,10,15,17-pentaen-2-one;(4R,6E,10E,12Z)-16,18-dihydroxy-4-methyl-15-(oxan-2-yl)-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(18),6,10,14,16-pentaen-2-one;(4R,6E,10E,12E)-16,18-dihydroxy-4-methyl-15-(oxan-2-yl)-12-phenylmethoxyimino-3-oxabicyclo[12.4.0]octadeca-1(18),6,10,14,16-pentaen-2-one is sourced from PubChem (CID 172963149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).