CAS Registry Number®
22189-32-8
CAS Name
Spectinomycin dihydrochloride pentahydrate
Molecular Formula
C14H24N2O7.2ClH.5H2O
Other Names and Identifiers
InChI
InChI=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
InChIKey
InChIKey=DCHJOVNPPSBWHK-UXXUFHFZSA-N
SMILES
N(C)[C@@H]1[C@@]2([C@](O[C@]3([C@@](O)(O2)C(=O)C[C@@H](C)O3)[H])([C@@H](O)[C@H](NC)[C@@H]1O)[H])[H].Cl.O
Canonical SMILES
Cl.O=C1CC(OC2OC3C(O)C(NC)C(O)C(NC)C3OC12O)C.O
Other Names for this Substance
- 4H-Pyrano[2,3-b][1,4]benzodioxin-4-one, decahydro-4a,7,9-trihydroxy-2-methyl-6,8-bis(methylamino)-, hydrochloride, hydrate (1:2:5), (2R,4aR,5aR,6S,7S,8R,9S,9aR,10aS)-
- 4H-Pyrano[2,3-b][1,4]benzodioxin-4-one, decahydro-4a,7,9-trihydroxy-2-methyl-6,8-bis(methylamino)-, 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)-
- Spectinomycin dihydrochloride pentahydrate
- Spectinomycin hydrochloride hydrate
Deleted or Replaced CAS Registry Numbers
11034-37-0
