| SpectraBase Spectrum ID |
FNnotKqb8Mm |
| Name |
1,2,5-Dithiazocine-4-carboxylic acid, hexahydro-3,3-dimethyl-6-oxo-7-[[(phenylmethoxy)carbonyl]amino]-, methyl ester, (4S*,7R*)- |
| CAS Registry Number |
77628-06-9 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H22N2O5S2 |
| InChI |
InChI=1S/C17H22N2O5S2/c1-17(2)13(15(21)23-3)19-14(20)12(10-25-26-17)18-16(22)24-9-11-7-5-4-6-8-11/h4-8,12-13H,9-10H2,1-3H3,(H,18,22)(H,19,20)/t12-,13-/m0/s1 |
| InChIKey |
SCBYJXLMSLEIOA-STQMWFEESA-N |
| Molecular Weight |
398.492 g/mol |
| SMILES |
N1C([C@@](NC(=O)OCc2ccccc2)(CSSC([C@@]1(C(=O)OC)[H])(C)C)[H])=O |
| SPLASH |
splash10-0005-3009000000-69f61134531ac57c34fb |
| Source of Spectrum |
I-59-414-0 |
| Synonyms |
L-Carbobenzoxyamino-4D-carbomethoxy-3,3-dimethyl-6-oxoperhydro-1,2,5-dithiazocine |
| Wiley ID |
120671 |
![1,2,5-Dithiazocine-4-carboxylic acid, hexahydro-3,3-dimethyl-6-oxo-7-[[(phenylmethoxy)carbonyl]amino]-, methyl ester, (4S*,7R*)-](/api/spectrum/FNnotKqb8Mm/structure.png?h=300&w=458 "1,2,5-Dithiazocine-4-carboxylic acid, hexahydro-3,3-dimethyl-6-oxo-7-[[(phenylmethoxy)carbonyl]amino]-, methyl ester, (4S*,7R*)-")
