7-Epi Clindamycin structure

7-Epi Clindamycin

[3,4-dihydroxy-5-(4-methylsulfanylpyrrolo[2,3-d]pyrimidin-7-yl)oxolan-2-yl]methyl dihydrogen phosphate

Also Known As: 7-Epi Clindamycin|int2-31|[3,4-dihydroxy-5-(4-methylsulfanylpyrrolo[2,3-d]pyrimidin-7-yl)oxolan-2-yl]methyl dihydrogen phosphate|7H-Pyrrolo[2, 4-(methylthio)-7-(5-O-phosphono-.beta.-D-ribofuranosyl)-|4-(Methylsulfanyl)-7-(5-O-phosphonopentofuranosyl)-7H-pyrrolo[2,3-d]pyrimidine

CAS: 16684-22-3
Molecular Formula C12H16N3O7PS
Molecular Weight 377.04465 g/mol
LogP -1.8
Topological Polar Surface Area 172.0 Ų
Hydrogen Bond Donors 4
Hydrogen Bond Acceptors 10
Rotatable Bonds 5
Exact Mass 377.04465
Monoisotopic Mass 377.04465
Heavy Atoms 24
Complexity 497.0

Chemical Identifiers

CAS Number 16684-22-3
SMILES CSC1=NC=NC2=C1C=CN2C3C(C(C(O3)COP(=O)(O)O)O)O
InChIKey RDLNVHQUQZBWDF-UHFFFAOYSA-N

Product Overview

7-Epi Clindamycin (CAS 16684-22-3), with molecular formula C12H16N3O7PS and molecular weight 377.04465 g/mol. IUPAC: [3,4-dihydroxy-5-(4-methylsulfanylpyrrolo[2,3-d]pyrimidin-7-yl)oxolan-2-yl]methyl dihydrogen phosphate.

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