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CHEBI:27553 - 3'-deoxydihydrostreptomycin 3'α,6-bisphosphate

ChEBI IDCHEBI:27553
ChEBI Name3'-deoxydihydrostreptomycin 3'α,6-bisphosphate
Stars
ASCII Name3'-deoxydihydrostreptomycin 3'alpha,6-bisphosphate
Secondary ChEBI IDsCHEBI:1340, CHEBI:19845
Last Modified1 October 2007
DownloadsMolfile
FormulaC21H43N7O17P2
Net Charge0
Average Mass727.555
Monoisotopic Mass727.21907
SMILESCN[C@@H]1[C@H](O[C@H]2[C@H](O[C@H]3[C@H](O)[C@@H](OP(=O)(O)O)[C@H](NC(=N)N)[C@@H](O)[C@@H]3NC(=N)N)O[C@@H](C)[C@@H]2COP(=O)(O)O)O[C@@H](CO)[C@H](O)[C@H]1O
InChIInChI=1S/C21H43N7O17P2/c1-5-6(4-40-46(34,35)36)15(43-18-10(26-2)13(32)11(30)7(3-29)42-18)19(41-5)44-16-8(27-20(22)23)12(31)9(28-21(24)25)17(14(16)33)45-47(37,38)39/h5-19,26,29-33H,3-4H2,1-2H3,(H4,22,23,27)(H4,24,25,28)(H2,34,35,36)(H2,37,38,39)/t5-,6-,7-,8-,9+,10-,11-,12-,13-,14-,15+,16+,17-,18-,19-/m0/s1
InChIKeyGAODGIPKEKRVEC-MLIDHZNVSA-N
Roles Classification
Biological Role:
antimicrobial agent  A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
ChEBI Ontology
Outgoing Relation(s)
3'-deoxydihydrostreptomycin 3'α,6-bisphosphate (CHEBI:27553) is a 3'-deoxydihydrostreptomycin (CHEBI:19848)
3'-deoxydihydrostreptomycin 3'α,6-bisphosphate (CHEBI:27553) is a streptomycin phosphate (CHEBI:26787)
IUPAC Name 
(1R,2S,3S,4R,5S,6S)-2,4-dicarbamimidamido-3,6-dihydroxy-5-(phosphonooxy)cyclohexyl 3,5-dideoxy-2-O-[2-deoxy-2-(methylamino)-α-L-glucopyranosyl]-3-[(phosphonooxy)methyl]-α-L-arabinofuranoside
Synonyms  Source
3'-Deoxydihydrostreptomycin 3'alpha,6-bisphosphateKEGG COMPOUND
3'-deoxydihydrostreptomycin 3'α,6-bis(dihydrogen phosphate)ChEBI
Manual XrefsDatabases
C04709KEGG COMPOUND