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Details of Obtusifoliol

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Role	Metabolite
MPIMP ID	M000821
stereoisomer	(3.beta.,4.alpha.,5.alpha.)-
isotopomer	ambient
formula	C30H50O
molecular mass	426.719
monoisotopic mass	426.38617
InChI	InChI=1S/C30H50O/c1-19(2)20(3)9-10-21(4)23-13-17-30(8)26-12-11-24-22(5)27(31)15-16-28(24,6)25(26)14-18-29(23,30)7/h19,21-24,27,31H,3,9-18H2,1-2,4-8H3/t21-,22+,23-,24+,27+,28+,29-,30+/m1/s1
InChIKey	MMNYKQIDRZNIKT-VSADUBDNSA-N
class	Terpenoid (Sterols)
application/atom+xml	http://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Metabolite(guid%27eecd77b7-c927-4e6e-b634-dedfb042a6b9%27)

Synonyms of Obtusifoliol

property	value
BRENDA	32452
CAS	16910-32-0
ChEBI ID	ChEBI:581203
ChemSpider ID	58745
PubChem CID	65252
PubChem SID	92298569
synonym	Ergosta-8,24(28)-dien-3-ol, 4,14-dimethyl-, (3beta,4alpha,5alpha)-
synonym	obtusifoliol
8 synonym(s)

Derivatives of Obtusifoliol

analyte	stereoisomer	isotopomer
Obtusifoliol (1TMS)		ambient
1 analyte(s)

Reference substances of Obtusifoliol

reference substance	supplier	supplier code	lot
Obtusifoliol
1 reference substance(s)

Isotopomers and stereoisomers of Obtusifoliol

metabolite	stereoisomer	isotopomer
no hits!

Quantitative Obtusifoliol 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 Obtusifoliol 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 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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