Spectinomycin hydrochloride

(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

CAS: 22189-32-8

Molecular Formula	`C14H36Cl2N2O12`
Molecular Weight	495.3 g/mol
Topological Polar Surface Area	135.0 A2
Hydrogen Bond Donors	12
Hydrogen Bond Acceptors	14
Rotatable Bonds	2
Exact Mass	494.16452
Heavy Atoms	30
Complexity	478.0

Chemical Identifiers

CAS Number	22189-32-8
SMILES	`CC1CC(=O)C2(C(O1)OC3C(C(C(C(C3O2)NC)O)NC)O)O.O.O.O.O.O.Cl.Cl`
InChIKey	`DCHJOVNPPSBWHK-UXXUFHFZSA-N`

📖 Product Overview

Spectinomycin hydrochloride (CAS: 22189-32-8) is a chemical compound with molecular formula C14H36Cl2N2O12 and molecular weight 495.3 g/mol. Its IUPAC systematic name is (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. Topological Polar Surface Area 135.0 A2 Hydrogen Bond Donors 12 Hydrogen Bond Acceptors 14 Rotatable Bonds 2 Exact Mass 494.16452 Heavy Atoms 30 Complexity 478.0 InChI Key: DCHJOVNPPSBWHK-UXXUFHFZSA-N. SMILES: CC1CC(=O)C2(C(O1)OC3C(C(C(C(C3O2)NC)O)NC)O)O.O.O.O.O.O.Cl.Cl.

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