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Details of Senecionine

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Role Analyte
nameSenecionine
MPIMP IDA240012
isotopomerambient
formulaC18H25NO5
molecular mass335.396
monoisotopic mass335.17327
InChIInChI=1S/C18H25NO5/c1-4-12-9-11(2)18(3,22)17(21)23-10-13-5-7-19-8-6-14(15(13)19)24-16(12)20/h4-5,11,14-15,22H,6-10H2,1-3H3/b12-4-/t11-,14+,15+,18+/m0/s1
InChIKeyHKODIGSRFALUTA-RCDLFFMESA-N
substructure TMS0
substructure TBS0
substructure H3ON0
substructure CH3O0
retention index (VAR5 method, n-alkanes C10–C36)2,406.06
application/atom+xmlhttp://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%27c3da0e44-7484-4a51-983e-656b8fc1b2fc%27)

Synonyms of Senecionine

propertyvalue
BRENDA8636
CAS130-01-8
ChemSpider ID24534230
PubChem SID92297957
synonymB000995
synonymSenecionine
6 synonym(s)

Metabolite mapped to Senecionine

metabolitestereoisomerisotopomer
Senecionine  ambient
1 metabolite(s)

Reference spectra of Senecionine

replicaentry datedetectionmethodspecies
17/19/2007 11:16:30 AM MDN35Reference Substance
27/19/2007 11:16:30 AM VAR5Reference Substance
2 spectrum(a)
compound timestamp information
deposited at 7/16/2007 by Hummel J., Max Planck Institute of Molecular Plant Physiology, Bioinformatics, Am Muehlenberg 1, D-14476 Golm, Germany
last changed at 5/21/2012 by Hummel J., Max Planck Institute of Molecular Plant Physiology, Bioinformatics, Am Muehlenberg 1, D-14476 Golm, Germany
modified by users Strehmel N., Hummel J.
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