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Details of Cholecalciferol, 25-hydroxy-

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Role	Metabolite
MPIMP ID	M001153
stereoisomer
isotopomer	ambient
formula	C27H44O2
molecular mass	400.638
monoisotopic mass	400.33413
InChI	InChI=1S/C27H44O2/c1-19-10-13-23(28)18-22(19)12-11-21-9-7-17-27(5)24(14-15-25(21)27)20(2)8-6-16-26(3,4)29/h11-12,20,23-25,28-29H,1,6-10,13-18H2,2-5H3/b21-11+,22-12-/t20-,23+,24-,25+,27-/m1/s1
InChIKey	JWUBBDSIWDLEOM-DTOXIADCSA-N
class
application/atom+xml	http://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Metabolite(guid%27b91135ec-8937-4d8b-a533-ccd82f33c1b0%27)

Synonyms of Cholecalciferol, 25-hydroxy-

property	value
BRENDA	14469
CAS	19356-17-3
ChEBI ID	ChEBI:17933
ChEBI ontology	has role bone density conservation agent
ChEBI ontology	has role nutraceutical
ChEBI ontology	has role vitamin
ChEBI ontology	is a hydroxycalciol
ChemSpider ID	4446820
MetaCyc	CALCIDIOL
PubChem CID	5283731
25 synonym(s)
Page of 3 Results per page:

Derivatives of Cholecalciferol, 25-hydroxy-

analyte	stereoisomer	isotopomer
Cholecalciferol, 25-hydroxy- (2TMS) MP		ambient
Cholecalciferol, 25-hydroxy- (2TMS) BP		ambient
2 analyte(s)

Reference substances of Cholecalciferol, 25-hydroxy-

reference substance	supplier	supplier code	lot
Cholecalciferol, 25-hydroxy-	Sigma	H4014	112K1452
1 reference substance(s)

Isotopomers and stereoisomers of Cholecalciferol, 25-hydroxy-

metabolite	stereoisomer	isotopomer
no hits!

Quantitative Cholecalciferol, 25-hydroxy- 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.

Name	Organism	Factor	Heatmap	Box plot	Variance	Anova F score
no metabolite profile(s) found.

Qualitative Cholecalciferol, 25-hydroxy- Profile Data

species
no qualitative metabolite profile data available!

compound timestamp information
deposited	at 4/17/2009 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.

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