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nebramycin 5'

PropertiesImage
MNX_IDMNXM64297 Image of MNXM64297
referencechebi:73679
formulaC19H43N6O10
global charge5
mol weight515.585
InChIKeyYPPFEJHOHNPKLT-PBSUHMDJSA-S
InChIInChI=1S/C19H38N6O10/c20-3-9-8(26)2-7(23)17(32-9)34-15-5(21)1-6(22)16(14(15)29)35-18-13(28)11(24)12(27)10(33-18)4-31-19(25)30/h5-18,26-29H,1-4,20-24H2,(H2,25,30)/p+5/t5-,6+,7+,8-,9+,10+,11-,12+,13+,14-,15+,16-,17+,18+/m0/s1
SMILESNC(=O)OC[C@H]1O[C@H](O[C@@H]2[C@@H](O)[C@H](O[C@H]3O[C@H](C[NH3+])[C@@H](O)C[C@H]3[NH3+])[C@@H]([NH3+])C[C@H]2[NH3+])[C@H](O)[C@@H]([NH3+])[C@@H]1O
MNX internals
InChI (mnx)InChI=1/C19H38N6O10/c20-3-9-8(26)2-7(23)17(32-9)34-15-5(21)1-6(22)16(14(15)29)35-18-13(28)11(24)12(27)10(33-18)4-31-19(25)30/h5-18,26-29H,1-4,20-24H2,(H2,25,30)/t5-,6+,7+,8-,9+,10+,11-,12+,13+,14-,15+,16-,17+,18+/m0/s1 Image of MNXM64297
SMILES (mnx)[CH2:1]1[C@H:5]([NH2:21])[C@@H:15]([O:34][C@@H:17]2[C@H:7]([NH2:23])[CH2:2][C@H:8]([OH:26])[C@@H:9]([CH2:3][NH2:20])[O:32]2)[C@H:14]([OH:29])[C@@H:16]([O:35][C@@H:18]2[C@H:13]([OH:28])[C@@H:11]([NH2:24])[C@H:12]([OH:27])[C@@H:10]([CH2:4][O:31][C:19](=[NH:25])[OH:30])[O:33]2)[C@@H:6]1[NH2:22]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)4
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:73679
chebi:73679
YPPFEJHOHNPKLT-PBSUHMDJSA-S 		nebramycin 5'
(1S,2S,3R,4S,6R)-4,6-diazaniumyl-3-[(2,6-diazaniumyl-2,3,6-trideoxy-alpha-D-ribo-hexopyranosyl)oxy]-2-hydroxycyclohexyl 3-azaniumyl-6-O-carbamoyl-3-deoxy-alpha-D-glucopyranoside
6''-O-carbamoyltobramycin(5+)
carbamoyl tobramycin
nebramycin 5'(5+)

kegg.compound:C18001
keggC:C18001
YPPFEJHOHNPKLT-PBSUHMDJSA-N 		Nebramycin 5'
6''-O-Carbamoyltobramycin
Nebramycin factor 5'

seed.compound:cpd19360
seedM:cpd19360
YPPFEJHOHNPKLT-PBSUHMDJSA-S 		Nebramycin factor 5'
6''-O-carbamoyltobramycin
nebramycin 5'
nebramycin V'
nebramycin factor 5'

CHEBI:73686
chebi:73686
YPPFEJHOHNPKLT-PBSUHMDJSA-N 		nebramycin 5'
(1S,2S,3R,4S,6R)-4,6-diamino-3-[(2,6-diamino-2,3,6-trideoxy-alpha-D-ribo-hexopyranosyl)oxy]-2-hydroxycyclohexyl 3-amino-6-O-carbamoyl-3-deoxy-alpha-D-glucopyranoside
6''-O-Carbamoyltobramycin
Nebramycin V'
Nebramycin factor 5'

metacyc.compound:CPD-14158
metacycM:CPD-14158
YPPFEJHOHNPKLT-PBSUHMDJSA-S 		nebramycin 5'
6''-O-carbamoyltobramycin
nebramycin V'
nebramycin factor 5'

keggC:M_C18001
seedM:M_cpd19360 		secondary/obsolete/fantasy identifier