Tożsamość

Spectinomycin Hydrochloride

Nie podano · C14H36Cl2N2O12

01Tożsamość

Lazychem ID	LC-53644
CAS RN	Nie podano
PubChem CID	30971
Molecular formula	C14H36Cl2N2O12
Molecular weight	495.3 g/mol
IUPAC name	(1R,3S,5R,8R,10R,11S,12S,13R,14S)-8,12,14-trihydroxy-5-methyl-11,13-bis(methylamino)-2,4,9-trioxatricyclo[8.4.0.03,8]tetradecan-7-one;pentahydrate;dihydrochloride
InChIKey	DCHJOVNPPSBWHK-UXXUFHFZSA-N

02Struktura i stereochemia

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

The parsed structure contains 3 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	3
Secondary amines	2
Tertiary amines	0

SMILES	C[C@@H]1CC(=O)[C@]2([C@@H](O1)O[C@@H]3[C@H]([C@@H]([C@@H]([C@@H]([C@H]3O2)NC)O)NC)O)O.O.O.O.O.O.Cl.Cl
InChI	Nie podano

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.