GOLM METABOLOME DATABASE

Details of Secologanin

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Role Metabolite
MPIMP IDM001111
stereoisomer 
isotopomerambient
formulaC17H24O10
molecular mass388.367
monoisotopic mass388.13695
InChIInChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3/t8-,9+,11-,12-,13+,14-,16+,17+/m1/s1
InChIKeyCSKKDSFETGLMSB-NRZPKYKESA-N
class 
application/atom+xmlhttp://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Metabolite(guid%27f19be380-c97e-46cc-89c6-f6bcafc793ec%27)

Synonyms of Secologanin

propertyvalue
BRENDA7954
CAS19351-63-4
ChEBI IDChEBI:18002
ChEBI ontologyis a beta-D-glucoside
ChEBI ontologyis a carboxylic ester
ChEBI ontologyis a iridoid monoterpenoid
ChEBI ontologyis a pyrans
ChemSpider ID141670
MetaCycSECOLOGANIN-CPD
PubChem CID161276
18 synonym(s)

Derivatives of Secologanin

Reference substances of Secologanin

reference substancesuppliersupplier codelot
SecologaninFluka50741 
SecologaninSigma5074134804067
2 reference substance(s)

Isotopomers and stereoisomers of Secologanin

Quantitative Secologanin Profile Data

Each graph visualises metabolite concentrations across a single metabolite profiling experiment. Each box plot represents relative (normalised) metabolite concentrations for single replica groups in the specific metabolite profiling experiment.
NameOrganismFactorHeatmapBox plotVarianceAnova F score
no metabolite profile(s) found.

Qualitative Secologanin Profile Data

species
no qualitative metabolite profile data available!
compound timestamp information
deposited at 4/16/2009 by Strehmel N., Max Planck Institute of Molecular Plant Physiology, Department of Molecular Plant Physiology (Prof. Willmitzer L), Am Muehlenberg 1, D-14476 Golm, Germany
last changed at 8/7/2013 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.
service last updated 17/02/2017 © 2008-2014 Golm Metabolome Database - All rights reserved
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