SpectraBase Spectrum ID |
Ef0CUZj9gq2 |
Name |
Methyl 3-butyroxymethyl-7-phthalimido-3-cephem-4-carboxylate |
CAS Registry Number |
103841-55-0 |
Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C21H20N2O7S |
InChI |
InChI=1S/C21H20N2O7S/c1-3-6-14(24)30-9-11-10-31-20-16(19(27)23(20)15(11)21(28)29-2)22-17(25)12-7-4-5-8-13(12)18(22)26/h4-5,7-8,16,20H,3,6,9-10H2,1-2H3/t16?,20-/m0/s1 |
InChIKey |
WBEAKZINQOQLFP-FZCLLLDFSA-N |
Molecular Weight |
444.458 g/mol |
SMILES |
C1(N2C(c3ccccc3C2=O)=O)C(=O)N2[C@]1(SCC(COC(=O)CCC)=C2C(=O)OC)[H] |
SPLASH |
splash10-000i-0920000000-6e107e6e3a463fcbae09 |
Source of Spectrum |
Y-22-1005-2 |
Synonyms |
Methyl (6S)-3-[(butyryloxy)methyl]-7-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate |
Wiley ID |
1385902 |