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Spectinomycin dihydrochloride pentahydrate

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For Research Use Only | Not For Clinical Use
CATAPS22189328B
CAS22189-32-8
Structure
MDL NumberMFCD00150886
SynonymsSpectinomycin hydrochloride hydrate, Spectinomycin dihydrochloride pentahydrate, 4H-Pyrano[2,3-b][1,4]benzodioxin-4-one, decahydro-4a,7,9-trihydroxy-2-methyl-6,8-bis(methylamino)-, dihydrochloride, pentahydrate, [2R-(2α,4aβ,5aβ,6β,7β,8β,9α,9aα,10aβ)]-, 4H-Pyrano[2,3-b][1,4]benzodioxin-4-one, decahydro-4a,7,9-trihydroxy-2-methyl-6,8-bis(methylamino)-, dihydrochloride, pentahydrate, (2R,4aR,5aR,6S,7S,8R,9S,9aR,10aS)- (9CI),4H-Pyrano[2,3-b][1,4]benzodioxin-4-one, decahydro-4a,7,9-trihydroxy-2-methyl-6,8-bis(methylamino)-, dihydrochloride, pentahydrate (8CI)
IUPAC Name(2R,4aR,5aR,6S,7S,8R,9S,9aR,10aS)-Decahydro-4a,7,9-trihydroxy-2-methyl-6,8-bis(methylamino)-4H-Pyrano[2,3-b][1,4]benzodioxin-4-one dihydrochloride pentahydrate
Molecular Weight495.3478
Molecular FormulaC14H24N2O7.2ClH.5H2O
EC Number244-554-3
Canonical SMILESO.O.O.O.O.Cl.Cl.CN[C@@H]1[C@H](O)[C@H](NC)[C@H]2O[C@]3(O)[C@@H](O[C@H](C)CC3=O)O[C@@H]2[C@H]1O
InChIInChI=1S/C14H24N2O7.2ClH.5H2O/c1-5-4-6(17)14(20)13(21-5)22-12-10(19)7(15-2)9(18)8(16-3)11(12)23-14
InChI KeyDCHJOVNPPSBWHK-UXXUFHFZSA-N
REAXYS Number5684150
Descriptionanalytical standard
SolubilityH2O: soluble at; Gram-positive bacteria
Accurate Mass494.1645
Formneat; gas chromatography (GC): suitable
FormatNeat
Gradeanalytical standard
ShippingRoom Temperature
Size250MG
Storage Conditions-18°C
SubcategoryPharmaceutical and veterinary compounds and metabolites, EU Methods
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