Identiteet

Clindamycin Impurity 16

Pole loetletud · C32H59ClN2O6S

01Identiteet

Lazychem ID	LC-32888
CAS RN	Pole loetletud
PubChem CID	169490896
Molecular formula	C32H59ClN2O6S
Molecular weight	635.3 g/mol
IUPAC name	[(2R,3R,4S,5R,6R)-6-[(1S,2S)-2-chloro-1-[[(2S,4R)-1-methyl-4-propylpyrrolidine-2-carbonyl]amino]propyl]-4,5-dihydroxy-2-methylsulfanyloxan-3-yl] tetradecanoate
InChIKey	RGULCXDJBDOAKJ-JOHJURLNSA-N

02Struktuur ja stereokeemia

Two-dimensional chemical structure of Clindamycin Impurity 16 — Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

The parsed structure contains 2 rings, includes aliphatic carbon, has 9 defined stereocentres, contains at least one halogen atom. These statements are calculated from the published structure string.

Defined stereocentres	9
Ring count	2
Secondary amines	0
Tertiary amines	1

SMILES	CCCCCCCCCCCCCC(=O)O[C@@H]1[C@H]([C@H]([C@H](O[C@@H]1SC)[C@@H]([C@H](C)Cl)NC(=O)[C@@H]2C[C@H](CN2C)CCC)O)O
InChI	Pole loetletud

03Stereochemistry

The published structure contains 9 defined and 0 unassigned tetrahedral stereocentres. The exact wedge and dash depiction is shown above.

Defined centres9Structure assigned

Unassigned centres0Structure unspecified

Assignment statusFully assignedExact published identity

Tetrahedral upper bound≤ 512Before symmetry reduction

Published same-connectivity configurations

1 record

These records have the same connectivity, molecular formula and protonation layer, but a different complete InChIKey stereochemical layer. Only separately structure-linked records are shown.