| SpectraBase Spectrum ID |
JVlsusy5gGM |
| Name |
4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 3-(3-ethoxy-3-oxo-1-propenyl)-3-methyl-7-oxo-6-[(phenoxyacetyl)amino]-, phenylmethyl ester, [2S-[2.alpha.,3.beta.(E),5.alpha.,6.beta.]]- |
| CAS Registry Number |
115234-75-8 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H28N2O7S |
| InChI |
InChI=1S/C27H28N2O7S/c1-3-34-21(31)14-15-27(2)23(26(33)36-16-18-10-6-4-7-11-18)29-24(32)22(25(29)37-27)28-20(30)17-35-19-12-8-5-9-13-19/h4-15,22-23,25H,3,16-17H2,1-2H3,(H,28,30)/b15-14+/t22-,23+,25-,27-/m1/s1 |
| InChIKey |
IIKNYTOBDUPRFI-GRJWORKWSA-N |
| Molecular Weight |
524.588 g/mol |
| SMILES |
N([C@@]1(C(N2[C@@]1(S[C@@]([C@@]2(C(OCc1ccccc1)=O)[H])(\C=C\C(=O)OCC)C)[H])=O)[H])C(=O)COc1ccccc1 |
| SPLASH |
splash10-000x-9106000000-bb5e964f16603099d32f |
| Source of Spectrum |
F-43-1008-8 |
| Synonyms |
benzyl (2S,3R,5R,6R)-3-[(1E)-3-ethoxy-3-oxo-1-propenyl]-3-methyl-7-oxo-6-[(phenoxyacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
Benzyl (2S,3S,5R,6R)-3-[(E)-3-ethoxy-3-oxopropen-1-yl]-3-methyl-7-oxo-6-phenoxyacetamido-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate |
| Wiley ID |
1402498 |
![4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 3-(3-ethoxy-3-oxo-1-propenyl)-3-methyl-7-oxo-6-[(phenoxyacetyl)amino]-, phenylmethyl ester, [2S-[2.alpha.,3.beta.(E),5.alpha.,6.beta.]]-](/api/spectrum/JVlsusy5gGM/structure.png?h=300&w=458 "4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 3-(3-ethoxy-3-oxo-1-propenyl)-3-methyl-7-oxo-6-[(phenoxyacetyl)amino]-, phenylmethyl ester, [2S-[2.alpha.,3.beta.(E),5.alpha.,6.beta.]]-")
