| SpectraBase Spectrum ID |
9JZNseUiSwZ |
| Name |
4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 3-methyl-3-[2-(1-methyl-1H-tetrazol-5-yl)ethenyl]-7-oxo-6-[(phenoxyacetyl)amino]-, phenylmethyl ester, [2S-[2.alpha.,3.beta.(E),5.alpha.,6.beta.]]- |
| CAS Registry Number |
115234-77-0 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C26H26N6O5S |
| InChI |
InChI=1S/C26H26N6O5S/c1-26(14-13-19-28-29-30-31(19)2)22(25(35)37-15-17-9-5-3-6-10-17)32-23(34)21(24(32)38-26)27-20(33)16-36-18-11-7-4-8-12-18/h3-14,21-22,24H,15-16H2,1-2H3,(H,27,33)/b14-13+/t21-,22+,24-,26+/m1/s1 |
| InChIKey |
UHXHESCLCHXHME-WQHJHJPBSA-N |
| Molecular Weight |
534.591 g/mol |
| SMILES |
N([C@@]1(C(N2[C@@]1(S[C@]([C@@]2(C(OCc1ccccc1)=O)[H])(\C=C\c1[n](nnn1)C)C)[H])=O)[H])C(=O)COc1ccccc1 |
| SPLASH |
splash10-0006-9100000000-04434b2e13087da5f98a |
| Source of Spectrum |
F-43-1008-10 |
| Synonyms |
benzyl (2S,3S,5R,6R)-3-methyl-3-[(E)-2-(1-methyl-1H-tetraazol-5-yl)ethenyl]-7-oxo-6-[(phenoxyacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
Benzyl (2S,3S,5R,6R)-3-methyl-3-[2-(1-methyl-1-H-tetrazol-5-yl)-(E)-ethenyl]-7-oxo-6-phenoxyacetamido-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate |
| Wiley ID |
1403781 |
![4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 3-methyl-3-[2-(1-methyl-1H-tetrazol-5-yl)ethenyl]-7-oxo-6-[(phenoxyacetyl)amino]-, phenylmethyl ester, [2S-[2.alpha.,3.beta.(E),5.alpha.,6.beta.]]-](/api/spectrum/9JZNseUiSwZ/structure.png?h=300&w=458 "4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 3-methyl-3-[2-(1-methyl-1H-tetrazol-5-yl)ethenyl]-7-oxo-6-[(phenoxyacetyl)amino]-, phenylmethyl ester, [2S-[2.alpha.,3.beta.(E),5.alpha.,6.beta.]]-")
