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Details of Amorpha-4,11-diene

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Role	Analyte
name	Amorpha-4,11-diene
MPIMP ID	A149010
isotopomer	ambient
formula	C15H24
molecular mass	204.352
monoisotopic mass	204.18780
InChI	InChI=1S/C15H24/c1-10(2)13-8-6-12(4)14-7-5-11(3)9-15(13)14/h9,12-15H,1,5-8H2,2-4H3/t12-,13+,14+,15-/m1/s1
InChIKey	HMTAHNDPLDKYJT-CBBWQLFWSA-N
substructure TMS
substructure TBS
substructure H3ON
substructure CH3O
retention index (VAR5 method, n-alkanes C10–C36)	1,493.25
application/atom+xml	http://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%27722ed7d6-c04e-4930-abd5-4fab553a6eef%27)

Synonyms of Amorpha-4,11-diene

property	value
ChEBI ID	CHEBI:52026
ChEBI ontology	is a sesquiterpene
ChemSpider ID	9227908
Experiment [JKopka]	PLEX_Artemisinin
publication	Ro DK et al. (2006) Production of the antimalarial drug precursor artemisinic acid in engineered yeast. Nature 440: 940-943 (DOI: 10.1038/nature04640)
synonym	(+)-amorpha-4,11-diene
synonym	(1R,4R,4aS,8aR)-4,7-dimethyl-1-(prop-1-en-2-yl)-1,2,3,4,4a,5,6,8a-octahydronaphthalene
synonym	amorpha-4,11-diene
synonym	characterisitic fragments 204, 91, 93, 105, 119, 121
synonym	heterologous expression of pRS425-Leu::ADS in Saccharomyces cerevisiae EPY224
13 synonym(s)
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Metabolite mapped to Amorpha-4,11-diene

metabolite	stereoisomer	isotopomer
Amorpha-4,11-diene		ambient
1 metabolite(s)

Reference spectra of Amorpha-4,11-diene

replica	entry date	method	species
3	6/25/2010 9:57:09 AM	VAR5	Artemisia annua
1	6/10/2010 12:36:02 PM	VAR5	Artemisia annua
4	6/25/2010 10:26:23 AM	VAR5	Artemisia annua
6	6/22/2012 12:28:10 PM	VAR5	Saccharomyces cerevisiae
8	7/9/2012 2:52:03 PM	VAR5
2	6/25/2010 9:46:03 AM	VAR5	Artemisia annua
5	6/22/2012 12:07:31 PM	VAR5	Saccharomyces cerevisiae
7 spectrum(a)

compound timestamp information
deposited	at 6/10/2010 by Kopka J., 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 12/8/2022 by unknown, Max Planck Institute of Molecular Plant Physiology, Am Muehlenberg 1, D-14476 Golm, Germany
modified by users	Kopka J., Hummel J., unknown

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