Feedback

Ketosantalic acid

Properties

Image

Occurences in reactions

MNX_ID

MNXM127094

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

formula

C₁₅H₂₂O₃

charge

mass

250.15689

reference

InChIKey

PJKNORSNWWYCMC-UHFFFAOYSA-N

InChI

InChI=1S/C15H22O3/c1-8(13(17)18)4-10(16)7-14(2)9-5-11-12(6-9)15(11,14)3/h8-9,11-12H,4-7H2,1-3H3,(H,17,18)

SMILES

CC(CC(=O)CC1(C)C2CC3C(C2)C31C)C(=O)O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:174301 chebi:174301	Ketosantalic acid 5-(2,3-dimethyl-3-tricyclo[2.2.1.02,6]heptanyl)-2-methyl-4-oxopentanoic acid
hmdb:HMDB0035358	Ketosantalic acid 5-{2,3-dimethyltricyclo[2.2.1.0²,⁶]heptan-3-yl}-2-methyl-4-oxopentanoate 5-{2,3-dimethyltricyclo[2.2.1.0²,⁶]heptan-3-yl}-2-methyl-4-oxopentanoic acid Ketosantalate
hmdb:HMDB35358	secondary/obsolete/fantasy identifier