| SpectraBase Spectrum ID |
2zIABAdMNZk |
| Name |
(2S)-3-(3-chloro-4-methoxy-phenyl)-2-[[(2E,5S,6R,7E)-5-hydroxy-6-methyl-8-phenyl-octa-2,7-dienoyl]amino]propionic acid 2,2,2-trichloroethyl ester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H29Cl4NO5 |
| InChI |
InChI=1S/C27H29Cl4NO5/c1-18(11-12-19-7-4-3-5-8-19)23(33)9-6-10-25(34)32-22(26(35)37-17-27(29,30)31)16-20-13-14-24(36-2)21(28)15-20/h3-8,10-15,18,22-23,33H,9,16-17H2,1-2H3,(H,32,34)/b10-6+,12-11+/t18-,22+,23+/m1/s1 |
| InChIKey |
UXLOXAFKTOAZSO-JFLFINEQSA-N |
| Molecular Weight |
589.343 g/mol |
| SMILES |
N([C@](C(OCC(Cl)(Cl)Cl)=O)(Cc1cc(Cl)c(cc1)OC)[H])C(\C=C\C[C@@]([C@@](\C=C\c1ccccc1)(C)[H])(O)[H])=O |
| SPLASH |
splash10-0a5c-2900000000-7e99ad8126c76da517b1 |
| Source of Spectrum |
C-117-2488-3 |
| Synonyms |
(2S)-3-(3-chloro-4-methoxyphenyl)-2-[[(2E,5S,6R,7E)-5-hydroxy-6-methyl-1-oxo-8-phenylocta-2,7-dienyl]amino]propanoic acid 2,2,2-trichloroethyl ester
2,2,2-trichloroethyl (2S)-3-(3-chloro-4-methoxy-phenyl)-2-[[(2E,5S,6R,7E)-5-hydroxy-6-methyl-8-phenyl-octa-2,7-dienoyl]amino]propanoate
2,2,2-tris(chloranyl)ethyl (2S)-3-(3-chloranyl-4-methoxy-phenyl)-2-[[(2E,5S,6R,7E)-6-methyl-5-oxidanyl-8-phenyl-octa-2,7-dienoyl]amino]propanoate |
| Wiley ID |
758764 |
![(2S)-3-(3-chloro-4-methoxy-phenyl)-2-[[(2E,5S,6R,7E)-5-hydroxy-6-methyl-8-phenyl-octa-2,7-dienoyl]amino]propionic acid 2,2,2-trichloroethyl ester](/api/spectrum/2zIABAdMNZk/structure.png?h=300&w=458 "(2S)-3-(3-chloro-4-methoxy-phenyl)-2-[[(2E,5S,6R,7E)-5-hydroxy-6-methyl-8-phenyl-octa-2,7-dienoyl]amino]propionic acid 2,2,2-trichloroethyl ester")
