GNPS Library Spectrum CCMSLIB00004689826

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Latest Library Spectrum Information
Spectrum IDCCMSLIB00004689826
Compound NameTACROLIMUS
PIMoNA
Data CollectorMoNA:VF-NPL-LTQ006336
CAS NumberN/A
Original Submittermwang87
Most Recent Revisormwang87
Library QualityBronze Spectrum
SmilesN/A
InChIInChI=1S/C44H69NO12/c1-10-13-31-19-25(2)18-26(3)20-37(54-8)40-38(55-9)22-28(5)44(52,57-40)41(49)42(50)45-17-12-11-14-32(45)43(51)56-39(29(6)34(47)24-35(31)48)27(4)21-30-15-16-33(46)36(23-30)53-7/h10,19,21,26,28-34,36-40,46-47,52H,1,11-18,20,22-24H2,2-9H3/b25-19-,27-21+/t26-,28+,29+,30-,31+,32-,33+,34-,36+,37-,38-,39+,40+,44+/m0/s1
Structure
NPAtlas/MIBiG
External Chemical ResourcesView All External Resources
Metabolomics Spectrum Resolvermzspec:GNPS:MONA:accession:CCMSLIB00004689826
Precursor M/Z826.469
Exact Mass0.0
Charge1
AdductM+Na
Ion SourceN/A
InstrumentLinear Ion Trap
Ion Modepositive
Spectrum Provenance Input FileDownload Provenance File
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Library MembershipMONA
SPLASH Keynull-null-null-null
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Spectrum Annotations and Comments
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CommentCompound NamePIAdductData_CollectorPrecursor_MZuser_idPubmed IDTime
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1CommentTACROLIMUSMoNAM+NaMoNA:VF-NPL-LTQ006336826.469mwang87N/A2018-10-08 19:44:36.0

Spectrum ID Ratings