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Details of Estriol

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Role	Metabolite
MPIMP ID	M000860
stereoisomer
isotopomer	ambient
formula	C18H24O3
molecular mass	288.382
monoisotopic mass	288.17255
InChI	InChI=1S/C18H24O3/c1-18-7-6-13-12-5-3-11(19)8-10(12)2-4-14(13)15(18)9-16(20)17(18)21/h3,5,8,13-17,19-21H,2,4,6-7,9H2,1H3/t13-,14-,15+,16-,17+,18+/m1/s1
InChIKey	PROQIPRRNZUXQM-ZXXIGWHRSA-N
class	Terpenoid (Sterols)
application/atom+xml	http://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Metabolite(guid%276ec6f23b-a991-4606-8bc7-146d915dab31%27)

Synonyms of Estriol

property	value
BRENDA	8583
CAS	50-27-1
ChEBI ID	ChEBI:27974
ChEBI ontology	has parent hydride estrane
ChEBI ontology	is a 16alpha-hydroxy steroid
ChEBI ontology	is a 17beta-hydroxy steroid
ChEBI ontology	is a 3-hydroxy steroid
ChEBI ontology	is a estrogen
ChemSpider ID	5553
MetaCyc	ESTRIOL
25 synonym(s)
Page of 3 Results per page:

Derivatives of Estriol

analyte	stereoisomer	isotopomer
Estriol (3TMS)		ambient
1 analyte(s)

Reference substances of Estriol

reference substance	supplier	supplier code	lot
Estriol	Sigma	46565	3069X
1 reference substance(s)

Isotopomers and stereoisomers of Estriol

metabolite	stereoisomer	isotopomer
no hits!

Quantitative Estriol 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 Estriol Profile Data

species
no qualitative metabolite profile data available!

compound timestamp information
deposited	at 8/29/2006 by Hummel J., Max Planck Institute of Molecular Plant Physiology, Bioinformatics, 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	Kopka J., Hummel J.

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