Secondary metabolite:Osthol



EOCID000893
Summary

sCentInDB Chemical identifier: EOCID000893

Chemical name: Osthol

Molecular formula: C15H16O3

SMILES: COc1ccc2c(c1CC=C(C)C)oc(=O)cc2

InChI: InChI=1S/C15H16O3/c1-10(2)4-7-12-13(17-3)8-5-11-6-9-14(16)18-15(11)12/h4-6,8-9H,7H2,1-3H3

InChIKey: MBRLOUHOWLUMFF-UHFFFAOYSA-N


Chemical classification

Kingdom: Organic compounds

Superclass: Phenylpropanoids and polyketides

Class: Coumarins and derivatives

Subclass:


Synonymous chemical name(s):
osthol, osthole


External chemical identifier(s):
CID:10228, CHEMBL52229, CHEMSPIDER:9811, ZINC000000000566, FDASRS:XH1TI1759C, MOLPORT:000-881-851, SURECHEMBL:SCHEMBL50436


Spectrabase ID:
FUyJ0V15gKA


Chemical structure download

2D:2D MOL2D MOL22D SDF
3D:3D MOL3D MOL23D SDF3D PDB3D PDBQT
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