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spectinomycin hydrochloride hydrate

PropertiesImageOccurences in reactions
MNX_IDMNXM161255Image of MNXM161255
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC14H36Cl2N2O12
charge0
mass494.16453
referencechebi:9217
InChIKeyDCHJOVNPPSBWHK-UXXUFHFZSA-N
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;;;;;;;/h5,7-13,15-16,18-20H,4H2,1-3H3;2*1H;5*1H2/t5-,7-,8+,9+,10+,11-,12-,13+,14+;;;;;;;/m1......./s1
SMILESCN[C@H]1[C@@H](O)[C@@H](NC)[C@H](O)[C@H]2O[C@@H]3O[C@H](C)CC(=O)[C@]3(O)O[C@H]12.Cl.Cl.O.O.O.O.O
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Similar chemical compounds in external resources
IdentifierDescription
CHEBI:9217
chebi:9217 		spectinomycin hydrochloride hydrate
(2R,4aR,5aR,6S,7S,8R,9S,9aR,10aS)-4a,7,9-trihydroxy-2-methyl-6,8-bis(methylamino)decahydro-4H-pyrano[2,3-b][1,4]benzodioxin-4-one dihydrochloride pentahydrate
(2R,4aR,5aR,6S,7S,8R,9S,9aR,10aS)-4a,7,9-trihydroxy-2-methyl-6,8-bis(methylamino)decahydro-4H-pyrano[2,3-b][1,4]benzodioxin-4-one dihydrochloride--water (1/5)
(2R,4aR,5aR,6S,7S,8R,9S,9aR,10aS)-4a,7,9-trihydroxy-N,N',2-trimethyl-4-oxodecahydro-2H-pyrano[2,3-b][1,4]benzodioxine-6,8-diaminium dichloride--water (1/5)
Spectinomycin dihydrochloride pentahydrate
Spectinomycin hydrochloride
Trobicin
U 18,400AE
U-18,409AE
kegg.drug:D00869
keggD:D00869 		Spectinomycin hydrochloride (USP)
Spectinomycin hydrochloride hydrate (JP18)
Trobicin (TN)
keggD:M_D00869 secondary/obsolete/fantasy identifier