Search MNXref
 Feedback

Artemisyl propionate

PropertiesImage
MNX_IDMNXM119364 Image of MNXM119364
referencechebi:174074
formulaC13H22O2
global charge0
mol weight210.317
InChIKeyOTRUQIDANLIZDL-UHFFFAOYSA-N
InChIInChI=1S/C13H22O2/c1-7-12(14)15-11(9-10(3)4)13(5,6)8-2/h8-9,11H,2,7H2,1,3-6H3
SMILESC=CC(C)(C)C(C=C(C)C)OC(=O)CC
MNX internals
InChI (mnx)InChI=1/C13H22O2/c1-7-12(14)15-11(9-10(3)4)13(5,6)8-2/h8-9,11H,2,7H2,1,3-6H3/t11? Image of MNXM119364
SMILES (mnx)[CH3:1][CH2:7][C:12](=[O:14])[O:15][CH:11]([CH:9]=[C:10]([CH3:3])[CH3:4])[C:13]([CH3:5])([CH3:6])[CH:8]=[CH2:2]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:174074
chebi:174074
OTRUQIDANLIZDL-UHFFFAOYSA-N 		Artemisyl propionate
3,3,6-trimethylhepta-1,5-dien-4-yl propanoate
hmdb:HMDB0041554
OTRUQIDANLIZDL-UHFFFAOYSA-N 		Artemisyl propionate
3,3,6-Trimethylhepta-1,5-dien-4-yl propanoic acid
3,3,6-trimethylhepta-1,5-dien-4-yl propanoate
Artemisyl propionic acid

hmdb:HMDB41554 		secondary/obsolete/fantasy identifier