GOLM METABOLOME DATABASE

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Details of Abietic acid

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Role	Metabolite
MPIMP ID	M000559
stereoisomer	L-
isotopomer	ambient
formula	C20H30O2
molecular mass	302.452
monoisotopic mass	302.22458
InChI	InChI=1S/C20H30O2/c1-13(2)14-6-8-16-15(12-14)7-9-17-19(16,3)10-5-11-20(17,4)18(21)22/h7,12-13,16-17H,5-6,8-11H2,1-4H3,(H,21,22)/t16-,17+,19+,20+/m0/s1
InChIKey	RSWGJHLUYNHPMX-ONCXSQPRSA-N
class	Terpenoid
application/atom+xml	http://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Metabolite(guid%27c32bf2bb-9f97-4af5-8f5e-06bc0ea97e83%27)

Synonyms of Abietic acid

property	value
BRENDA	10477
CAS	514-10-3
ChEBI ID	ChEBI:28987
ChEBI ontology	has role secondary metabolite
ChEBI ontology	is a abietane diterpenoid
ChEBI ontology	is a monocarboxylic acid
ChEBI ontology	is conjugate acid of abietate
ChemSpider ID	10127
PubChem CID	10569
PubChem SID	24891449
18 synonym(s)
Page of 2 Results per page:

Derivatives of Abietic acid

analyte	stereoisomer	isotopomer
Abietic acid (1TMS)		ambient
1 analyte(s)

Reference substances of Abietic acid

reference substance	supplier	supplier code	lot
Abietic acid	Sigma	00010	23304215
Abietic acid	Sigma	A9424	10K2604
2 reference substance(s)

Isotopomers and stereoisomers of Abietic acid

metabolite	stereoisomer	isotopomer
no hits!

Quantitative Abietic acid 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 Abietic acid 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 11/26/2013 by Hummel J., Max Planck Institute of Molecular Plant Physiology, Bioinformatics, Am Muehlenberg 1, D-14476 Golm, Germany
modified by users	Hummel J.

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