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CAS 1147438-61-6

:

7-[[2-Azido-2-deoxy-4,6-O-[(S)-phenylmethylene]-3-O-(2,3,4,6-tetra-O-acetyl-β-D-galactopyranosyl)-α-D-galactopyranosyl]oxy]-4-methyl-2H-1-benzopyran-2-one

Description:
The chemical substance with the name "7-[[2-Azido-2-deoxy-4,6-O-[(S)-phenylmethylene]-3-O-(2,3,4,6-tetra-O-acetyl-β-D-galactopyranosyl)-α-D-galactopyranosyl]oxy]-4-methyl-2H-1-benzopyran-2-one" and CAS number 1147438-61-6 is a complex organic compound characterized by its intricate structure, which includes multiple functional groups such as azido, acetyl, and glycosidic linkages. This compound features a benzopyran backbone, which is a fused ring system that contributes to its potential biological activity. The presence of azido groups suggests possible applications in click chemistry or as a precursor for further chemical modifications. The acetylated galactopyranosyl units indicate that this compound may exhibit properties related to carbohydrate chemistry, potentially influencing its solubility and reactivity. Overall, the structural complexity and functional diversity of this substance may render it of interest in medicinal chemistry, particularly in the development of glycosylated compounds with specific biological activities. Further studies would be necessary to elucidate its precise properties and potential applications.
Formula:C37H39N3O16
InChI:InChI=1S/C37H39N3O16/c1-17-13-28(45)52-25-14-23(11-12-24(17)25)51-36-29(39-40-38)32(30-27(53-36)16-47-35(55-30)22-9-7-6-8-10-22)56-37-34(50-21(5)44)33(49-20(4)43)31(48-19(3)42)26(54-37)15-46-18(2)41/h6-14,26-27,29-37H,15-16H2,1-5H3/t26-,27-,29-,30+,31+,32-,33+,34-,35+,36+,37+/m1/s1
InChI key:InChIKey=GJZSUWLDWDOLCR-HWVJYMAESA-N
SMILES:O([C@H]1[C@@]2([C@](O[C@H](OC=3C=C4C(=CC3)C(C)=CC(=O)O4)[C@@H]1N=[N+]=[N-])(CO[C@@H](O2)C5=CC=CC=C5)[H])[H])[C@H]6[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H](COC(C)=O)O6
Synonyms:
  • 2H-1-Benzopyran-2-one, 7-[[2-azido-2-deoxy-4,6-O-[(S)-phenylmethylene]-3-O-(2,3,4,6-tetra-O-acetyl-β-D-galactopyranosyl)-α-D-galactopyranosyl]oxy]-4-methyl-
  • 7-[[2-Azido-2-deoxy-4,6-O-[(S)-phenylmethylene]-3-O-(2,3,4,6-tetra-O-acetyl-β-D-galactopyranosyl)-α-D-galactopyranosyl]oxy]-4-methyl-2H-1-benzopyran-2-one
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