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3-Oxo-1,4,11(13)-eudesmatrien-12-oic acid

Properties

Image

Occurences in reactions

MNX_ID

MNXM117591

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

formula

C₁₅H₁₈O₃

charge

mass

246.12559

reference

InChIKey

FPCQVGOUFYTXFX-UHFFFAOYSA-N

InChI

InChI=1S/C15H18O3/c1-9(14(17)18)11-4-6-15(3)7-5-13(16)10(2)12(15)8-11/h5,7,11H,1,4,6,8H2,2-3H3,(H,17,18)

SMILES

C=C(C(=O)O)C1CCC2(C)C=CC(=O)C(C)=C2C1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
hmdb:HMDB0037558	3-Oxo-1,4,11(13)-eudesmatrien-12-oic acid 2-(4a,8-Dimethyl-7-oxo-1,2,3,4,4a,7-hexahydronaphthalen-2-yl)prop-2-enoate 2-(4a,8-dimethyl-7-oxo-1,2,3,4,4a,7-hexahydronaphthalen-2-yl)prop-2-enoic acid 2-(4a,8-dimethyl-7-oxo-1,2,3,4-tetrahydronaphthalen-2-yl)prop-2-enoic acid 3-oxo-1,4,11(13)-Eudesmatrien-12-Oate
hmdb:HMDB37558	secondary/obsolete/fantasy identifier