SpectraBase Spectrum ID |
JP0Y2qC1Ipz |
Name |
(3S,4S,5R,6R)-4-(2-Chlorphenyl)-5-nitro-3-((4E,6E)-octa-4,6-dienyl)-6-phenylcyclohex-1-ene-carbaldehyde |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C27H28ClNO3 |
InChI |
InChI=1S/C27H28ClNO3/c1-2-3-4-5-6-8-15-21-18-22(19-30)25(20-13-9-7-10-14-20)27(29(31)32)26(21)23-16-11-12-17-24(23)28/h2-5,7,9-14,16-19,21,25-27H,6,8,15H2,1H3/b3-2+,5-4+/t21-,25+,26-,27-/m0/s1 |
InChIKey |
DLRYVKCASLJZSZ-VTYQVQNYSA-N |
Literature Reference DOI |
10.1002/adsc.200700396 |
Molecular Weight |
449.978 g/mol |
SMILES |
C1(=C[C@@]([C@]([C@]([C@@]1(c1ccccc1)[H])([N+](=O)[O-])[H])(c1c(cccc1)Cl)[H])(CCC\C=C\C=C\C)[H])C=O |
SPLASH |
splash10-0ufr-2591400000-48eca0cc0bf7a9b96126 |
Source of Spectrum |
ASC-350-267/SM13-36d |
Synonyms |
(1'S,2'R,3'R,6'S)-2-chloro-2'-nitro-6'-((4E,6E)-octa-4,6-dien-1-yl)-1',2',3',6'-tetrahydro-[1,1':3',1''-terphenyl]-4'-carbaldehyde |
Wiley ID |
1766002 |