GNPS Library Spectrum CCMSLIB00000075309

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Latest Library Spectrum Information
Spectrum IDCCMSLIB00000075309
Compound NameStreptomycin
PIDorrestein/Moore
Data CollectorRoland Kersten
CAS NumberN/A
Original Submittermcruesemann
Most Recent Revisorlfnothias
Library QualityBronze Spectrum
SmilesC[C@H]1[C@@]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@@H]([C@H]([C@@H]([C@H]2O)O)N=C(N)N)O)N=C(N)N)O[C@H]3[C@H]([C@@H]([C@H]([C@@H](O3)CO)O)O)NC)(C=O)O
InChI"InChI=1S/C21H39N7O12/c1-5-21(36,4-30)16(40-17-9(26-2)13(34)10(31)6(3-29)38-17)18(37-5)39-15-8(28-20(24)25)11(32)7(27-19(22)23)12(33)14(15)35/h4-18,26,29,31-36H,3H2,1-2H3,(H4,22,23,27)(H4,24,25,28)/t5-,6-,7+,8-,9-,10-,11+,12-,13-,14+,15+,16-,17-,18-,21+/m0/s1"
Structure
NPAtlas/MIBiG
External Chemical ResourcesView All External Resources
Metabolomics Spectrum Resolvermzspec:GNPS:GNPS-LIBRARY:accession:CCMSLIB00000075309
Precursor M/Z582.273
Exact Mass581.266
Charge1
AdductM+H
Ion SourceDI-ESI
InstrumentIon Trap
Ion ModePositive
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Library MembershipGNPS-LIBRARY
SPLASH Keysplash10-0296-0062290000-13a4af066603927849d4
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Spectrum Tags

Datasets ID
Hits 1 ~ 1 out of 1     Go to   
TypeDescriptionDatabaseURLURLRemove Tag
checked only
1Drug ClassAntibioticlinkout

Spectrum Annotation History

Spectrum Annotations and Comments
Hits 1 ~ 2 out of 2     Go to   
CommentCompound NamePIAdductData_CollectorPrecursor_MZuser_idPubmed IDTime
checked only
1CommentStreptomycinDorrestein/MooreM+HRoland Kersten582.273lfnothiasN/A2020-10-23 13:11:19.0
2CommentStreptomycinDorrestein/MooreM+HRoland Kersten582.0mcruesemannN/A2014-04-09 13:17:51.0

Spectrum ID Ratings