| SpectraBase Spectrum ID |
3KgIc27ZRQk |
| Name |
4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 3-methyl-7-oxo-3-(3-oxo-3-phenyl-1-propenyl)-6-[(phenoxyacetyl)amino]-, phenylmethyl ester, [2S-[2.alpha.,3.beta.(E),5.alpha.,6.beta.]]- |
| CAS Registry Number |
115234-80-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C31H28N2O6S |
| InChI |
InChI=1S/C31H28N2O6S/c1-31(18-17-24(34)22-13-7-3-8-14-22)27(30(37)39-19-21-11-5-2-6-12-21)33-28(36)26(29(33)40-31)32-25(35)20-38-23-15-9-4-10-16-23/h2-18,26-27,29H,19-20H2,1H3,(H,32,35)/b18-17+/t26-,27+,29-,31+/m0/s1 |
| InChIKey |
MMEUIANMQISRCL-DSYJPASDSA-N |
| Molecular Weight |
556.633 g/mol |
| SMILES |
N([C@]1(C(N2[C@]1(S[C@@]([C@]2(C(OCc1ccccc1)=O)[H])(\C=C\C(=O)c1ccccc1)C)[H])=O)[H])C(=O)COc1ccccc1 |
| SPLASH |
splash10-0006-9002000000-e80c62b6119c843b46dd |
| Source of Spectrum |
F-43-1009-12 |
| Synonyms |
benzyl (2R,3R,5S,6S)-3-methyl-7-oxo-3-[(1E)-3-oxo-3-phenyl-1-propenyl]-6-[(phenoxyacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
Benzyl (2S,3S,5R,6R)-3-methyl-7-oxo-3-[(E)-3-oxo-phenylpropen-1-yl]-6-phenoxyacetamido-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate |
| Wiley ID |
1406394 |
![4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 3-methyl-7-oxo-3-(3-oxo-3-phenyl-1-propenyl)-6-[(phenoxyacetyl)amino]-, phenylmethyl ester, [2S-[2.alpha.,3.beta.(E),5.alpha.,6.beta.]]-](/api/spectrum/3KgIc27ZRQk/structure.png?h=300&w=458 "4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 3-methyl-7-oxo-3-(3-oxo-3-phenyl-1-propenyl)-6-[(phenoxyacetyl)amino]-, phenylmethyl ester, [2S-[2.alpha.,3.beta.(E),5.alpha.,6.beta.]]-")
