Met009758: Tanzawaic acid E
Metabolite Information
Name
Tanzawaic acid E
IUPAC Name
(2E,4E)-5-[(1R,2R,4aS,6S,8S,8aR)-6-hydroxy-2,6,8-trimethyl-2,4a,5,7,8,8a-hexahydro-1H-naphthalen-1-yl]penta-2,4-dienoic acid
Molecular Formula
C18H26O3
Molecular Weight
290.4
Exact Mass
290.1881947
SMILES
CC1CC(CC2C1C(C(C=C2)C)C=CC=CC(=O)O)(C)O
InChIKey
GGRDDTWLVPZMAU-KWMARLCDSA-N
InChI
InChI=1S/C18H26O3/c1-12-8-9-14-11-18(3,21)10-13(2)17(14)15(12)6-4-5-7-16(19)20/h4-9,12-15,17,21H,10-11H2,1-3H3,(H,19,20)/b6-4+,7-5+/t12-,13+,14-,15-,17-,18+/m1/s1
Other Databases Link
Structure
2D Structure
3D Structure
Classification
(data sourced from ClassyFire)
Kingdom:
Organic compounds
Superclass:
Lipids and lipid-like molecules
Class:
Fatty Acyls
Subclass:
Fatty acids and conjugates
Crops containing this metabolite
banana
grape
mango
muskmelon
pear
turnip
watermelon
yam
grape
mango
muskmelon
pear
turnip
watermelon
yam
Metabolite Spectrum Accession Label