Met000083: 6-Hydroxyangelicin
Metabolite Information
Name
6-Hydroxyangelicin
IUPAC Name
6-hydroxyfuro[2,3-h]chromen-2-one
Molecular Formula
C11H6O4
Molecular Weight
202.16
Exact Mass
202.0266087
SMILES
C1=CC(=O)OC2=C3C=COC3=C(C=C21)O
InChIKey
ZKCVFMVZXPEHMD-UHFFFAOYSA-N
InChI
InChI=1S/C11H6O4/c12-8-5-6-1-2-9(13)15-10(6)7-3-4-14-11(7)8/h1-5,12H
Other Databases Link
Structure
2D Structure
3D Structure
Classification
(data sourced from ClassyFire)
Kingdom:
Organic compounds
Superclass:
Phenylpropanoids and polyketides
Class:
Coumarins and derivatives
Subclass:
Furanocoumarins
Crops containing this metabolite
lemon
parsley
parsley
Metabolite Spectrum Accession Label