SpectraBase Spectrum ID |
215uF3lFpzr |
Name |
2-[(1S,2R)-2-[(R)-cyano-[[(4S,5S)-2,2-dimethyl-4-phenyl-1,3-dioxan-5-yl]-methyl-amino]-phenyl-methyl]-6-keto-cyclohexyl]acetic acid methyl ester |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C30H36N2O5 |
InChI |
InChI=1S/C30H36N2O5/c1-29(2)36-19-25(28(37-29)21-12-7-5-8-13-21)32(3)30(20-31,22-14-9-6-10-15-22)24-16-11-17-26(33)23(24)18-27(34)35-4/h5-10,12-15,23-25,28H,11,16-19H2,1-4H3/t23-,24+,25-,28-,30-/m0/s1 |
InChIKey |
PHZFTKNVAUUEPC-KWDKPLCGSA-N |
Molecular Weight |
504.627 g/mol |
SMILES |
[C@@](N([C@@]1([C@@](OC(OC1)(C)C)(c1ccccc1)[H])[H])C)([C@]1([C@@](C(=O)CCC1)(CC(=O)OC)[H])[H])(C#N)c1ccccc1 |
SPLASH |
splash10-00dl-5922000000-e67d7ba5309d2b388099 |
Source of Spectrum |
SO-0-662-4 |
Synonyms |
2-[(1S,2R)-2-[(R)-cyano-[[(4S,5S)-2,2-dimethyl-4-phenyl-1,3-dioxan-5-yl]-methylamino]-phenylmethyl]-6-oxocyclohexyl]acetic acid methyl ester
Methyl 2-[(1S,2R)-2-[(R)-cyano-[[(4S,5S)-2,2-dimethyl-4-phenyl-1,3-dioxan-5-yl]-methyl-amino]-phenyl-methyl]-6-oxidanylidene-cyclohexyl]ethanoate
Methyl 2-[(1S,2R)-2-[(R)-cyano-[[(4S,5S)-2,2-dimethyl-4-phenyl-1,3-dioxan-5-yl]-methyl-amino]-phenyl-methyl]-6-oxo-cyclohexyl]acetate |
Wiley ID |
873051 |