GNPS Library Spectrum CCMSLIB00011431730

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Latest Library Spectrum Information
Spectrum IDCCMSLIB00011431730
Compound NameHymenotamayonin B
PIJL Wolfender
Data CollectorLuis Quiros
Pubmed
CAS Number
Original Submitterquirosgu
Most Recent Revisorquirosgu
Library QualityBronze Spectrum
SmilesC/C(C)=C\CC1=CC([C@@]([C@]23C/C=C(C)\C)([H])CC[C@@](C(O)=CC2=O)(C3=O)C/C=C(C)\C)=CC(O)=C1O
InChIInChI=1S/C30H38O5/c1-18(2)7-8-21-15-22(16-24(31)27(21)34)23-11-13-29(12-9-19(3)4)25(32)17-26(33)30(23,28(29)35)14-10-20(5)6/h7,9-10,15-17,23,31-32,34H,8,11-14H2,1-6H3/t23-,29+,30-/m1/s1
Structure
NPAtlas/MIBiG
External Chemical ResourcesView All External Resources
Metabolomics Spectrum Resolvermzspec:GNPS:GNPS-LIBRARY:accession:CCMSLIB00011431730
Precursor M/Z479.279
Exact Mass479.279
Charge1
AdductM+H
Ion SourceLC-ESI
InstrumentOrbitrap
Ion ModePositive
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Library MembershipGNPS-LIBRARY
SPLASH Keynull-null-null-null
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Spectrum Annotation History

Spectrum Annotations and Comments
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CommentCompound NamePIAdductData_CollectorPrecursor_MZuser_idPubmed IDTime
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1CommentHymenotamayonin BJL WolfenderM+HLuis Quiros479.279quirosgu 2023-07-27 05:14:43.0

Spectrum ID Ratings