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(+)-artemisinate

Properties

Image

Occurences in reactions

MNX_ID

MNXM13415

	#reac
in my sandbox	0
in MNXref (generic)	15
in models (compartimentalized)	0

formula

C₁₅H₂₁O₂

charge

-1

mass

233.1547

reference

InChIKey

PLQMEXSCSAIXGB-SAXRGWBVSA-M

InChI

InChI=1S/C15H22O2/c1-9-4-6-12-10(2)5-7-13(14(12)8-9)11(3)15(16)17/h8,10,12-14H,3-7H2,1-2H3,(H,16,17)/p-1/t10-,12+,13+,14+/m1/s1

SMILES

C=C(C(=O)[O-])[C@@H]1CC[C@@H](C)[C@@H]2CCC(C)=C[C@@H]21

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:64782 chebi:64782	(+)-artemisinate 2-[(1R,4R,4aS,8aR)-4,7-dimethyl-1,2,3,4,4a,5,6,8a-octahydronaphthalen-1-yl]prop-2-enoate artemisinate
CHEBI:63749 chebi:63749	(+)-artemisinic acid 2-[(1R,4R,4aS,8aR)-4,7-dimethyl-1,2,3,4,4a,5,6,8a-octahydronaphthalen-1-yl]prop-2-enoic acid artemisic acid artemisinic acid
lipidmaps:LMPR0103190015 lipidmapsM:LMPR0103190015	(+)-artemisinic acid 2-[(1R,4R,4aS,8aR)-4,7-dimethyl-1,2,3,4,4a,5,6,8a-octahydronaphthalen-1-yl]prop-2-enoic acid artemisinic acid
kegg.compound:C20309 keggC:C20309	Artemisinate Artemisinic acid
seed.compound:cpd23797 seedM:cpd23797	artemisinate Artemisinate Artemisinic acid artemisinic acid
metacyc.compound:CPD-13248 metacycM:CPD-13248	artemisinate artemisinic acid
keggC:M_C20309 seedM:M_cpd23797	secondary/obsolete/fantasy identifier