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kanamycin B

PropertiesImage
MNX_IDMNXM4629 Image of MNXM4629
referencechebi:58549
formulaC18H42N5O10
global charge5
mol weight488.559
InChIKeySKKLOUVUUNMCJE-FQSMHNGLSA-S
InChIInChI=1S/C18H37N5O10/c19-2-6-11(26)12(27)9(23)17(30-6)32-15-4(20)1-5(21)16(14(15)29)33-18-13(28)8(22)10(25)7(3-24)31-18/h4-18,24-29H,1-3,19-23H2/p+5/t4-,5+,6+,7+,8-,9+,10+,11+,12+,13+,14-,15+,16-,17+,18+/m0/s1
SMILES[NH3+]C[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H]([NH3+])[C@H]3O)[C@H]([NH3+])C[C@@H]2[NH3+])[C@H]([NH3+])[C@@H](O)[C@@H]1O
MNX internals
InChI (mnx)InChI=1/C18H37N5O10/c19-2-6-11(26)12(27)9(23)17(30-6)32-15-4(20)1-5(21)16(14(15)29)33-18-13(28)8(22)10(25)7(3-24)31-18/h4-18,24-29H,1-3,19-23H2/t4-,5+,6+,7+,8-,9+,10+,11+,12+,13+,14-,15+,16-,17+,18+/m0/s1 Image of MNXM4629
SMILES (mnx)[CH2:1]1[C@H:4]([NH2:20])[C@@H:15]([O:32][C@@H:17]2[C@H:9]([NH2:23])[C@@H:12]([OH:27])[C@H:11]([OH:26])[C@@H:6]([CH2:2][NH2:19])[O:30]2)[C@H:14]([OH:29])[C@@H:16]([O:33][C@@H:18]2[C@H:13]([OH:28])[C@@H:8]([NH2:22])[C@H:10]([OH:25])[C@@H:7]([CH2:3][OH:24])[O:31]2)[C@@H:5]1[NH2:21]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)12
in models (compartimentalized) 1
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:58549
chebi:58549
SKKLOUVUUNMCJE-FQSMHNGLSA-S 		kanamycin B
(1R,2S,3S,4R,6S)-4,6-diammmonio-3-(3-ammonio-3-deoxy-alpha-D-glucopyranosyloxy)-2-hydroxycyclohexyl 2,6-diammmonio-2,6-dideoxy-alpha-D-glucopyranoside
kanamycin B(5+)

kegg.drug:D07497
keggD:D07497
SKKLOUVUUNMCJE-FQSMHNGLSA-N 		Bekanamycin (INN)
Kanamycin B

seed.compound:cpd00615
seedM:cpd00615
SKKLOUVUUNMCJE-FQSMHNGLSA-S 		Bekanamycin
Kanamycin B
Nebramycin factor 5
bekanamycin
kanamycin B
kanamycin-B
nebramycin factor 5

sabiork.compound:5255
sabiorkM:5255
kegg.compound:C00825
keggC:C00825
SKKLOUVUUNMCJE-FQSMHNGLSA-N 		Kanamycin B
Bekanamycin
Nebramycin factor 5

CHEBI:28098
chebi:28098
SKKLOUVUUNMCJE-FQSMHNGLSA-N 		kanamycin B
(1R,2S,3S,4R,6S)-4,6-diamino-3-(3-amino-3-deoxy-alpha-D-glucopyranosyloxy)-2-hydroxycyclohexyl 2,6-diamino-2,6-dideoxy-alpha-D-glucopyranoside
2'-amino-2'-deoxykanamycin
Bekanamycin
Kanamycin B
Nebramycin V
Nebramycin factor 5
O-3-amino-3-deoxy-alpha-D-glucopyranosyl-(1->4)-O-(2,6-diamino-2,6-dideoxy-alpha-D-glucopyranosyl-(1->6))-2-deoxy-D-streptamine

metacyc.compound:CPD-4822
metacycM:CPD-4822
SKKLOUVUUNMCJE-FQSMHNGLSA-S 		kanamycin B
bekanamycin
kanamycin-B
nebramycin factor 5

chebi:14489
chebi:24948
chebi:24949
chebi:6107
keggC:M_C00825
keggD:M_D07497
seedM:M_cpd00615 		secondary/obsolete/fantasy identifier