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CHEBI:27944 - 3'-deoxydihydrostreptomycin 3'',6-bisphosphate

ChEBI IDCHEBI:27944
ChEBI Name3'-deoxydihydrostreptomycin 3'',6-bisphosphate
Stars
Secondary ChEBI IDsCHEBI:1341, CHEBI:19846
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]2CO)O[C@@H](CO)[C@H](O)[C@H]1OP(=O)(O)O
InChIInChI=1S/C21H43N7O17P2/c1-5-6(3-29)14(42-18-10(26-2)17(45-47(37,38)39)11(31)7(4-30)41-18)19(40-5)43-15-8(27-20(22)23)12(32)9(28-21(24)25)16(13(15)33)44-46(34,35)36/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
InChIKeyPVNBAUCASRIGKP-AWMQQPGVSA-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'',6-bisphosphate (CHEBI:27944) is a 3'-deoxydihydrostreptomycin (CHEBI:19848)
3'-deoxydihydrostreptomycin 3'',6-bisphosphate (CHEBI:27944) is a streptomycin phosphate (CHEBI:26787)
IUPAC Name 
(1S,2R,3S,4S,5R,6S)-2,4-dicarbamimidamido-5-({3,5-dideoxy-2-O-[2-deoxy-2-(methylamino)-3-O-phosphono-α-L-glucopyranosyl]-3-(hydroxymethyl)-α-L-arabinofuranosyl}oxy)-3,6-dihydroxycyclohexyl dihydrogen phosphate
Synonym  Source
3'-Deoxydihydrostreptomycin 6,3''-bis-phosphateKEGG COMPOUND
Manual XrefsDatabases
C04660KEGG COMPOUND