CHEBI ONTOLOGY - ANNOTATIONS
The Chemical Entities of Biological Interest (ChEBI) ontology is downloaded weekly from EMBL-EBI at http://www.ebi.ac.uk/chebi/ . The data is made available under the Creative Commons License (CC BY 3.0, http://creativecommons.org/licenses/by/3.0/ ). For more information see: Degtyarenko et al. (2008) ChEBI: a database and ontology for chemical entities of biological interest. Nucleic Acids Res. 36, D344–D350.
Term: rel-(7R,8R,7'R,8'R)-3',4'-methylenedioxy-3,4,5,5'-tetramethoxy-7,7'-epoxylignan
Accession: CHEBI:69322
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Definition: A lignan that has formula C23H28O7.
Synonyms: related_synonym: Formula=C23H28O7; InChI=1S/C23H28O7/c1-12-13(2)21(15-9-18(26-5)23-19(10-15)28-11-29-23)30-20(12)14-7-16(24-3)22(27-6)17(8-14)25-4/h7-10,12-13,20-21H,11H2,1-6H3/t12-,13-,20-,21-/m1/s1; InChIKey=RKSBJQZDPAGEQW-QNLIWRIUSA-N; SMILES=COc1cc(cc(OC)c1OC)[C@@H]1O[C@H]([C@H](C)[C@H]1C)c1cc(OC)c2OCOc2c1; rel-6-[(2R,3R,4R,5R)-3,4-dimethyl-5-(3,4,5-trimethoxyphenyl)oxolan-2-yl]-4-methoxy-1,3-benzodioxole
xref: PMID:21846089
Term paths to the root one shortest all shortest one longest all longest one shortest and longest all
Path 1
CHEBI ontology
19844
role
19820
biological role
19818
biochemical role
19525
metabolite
19512
rel-(7R,8R,7'R,8'R)-3',4'-methylenedioxy-3,4,5,5'-tetramethoxy-7,7'-epoxylignan
0
Path 2
CHEBI ontology
19844
subatomic particle
19842
composite particle
19842
hadron
19842
baryon
19842
nucleon
19809
atomic nucleus
19842
atom
19842
main group element atom
19792
p-block element atom
19792
p-block molecular entity
19792
carbon group molecular entity
19738
organic molecular entity
19734
organic molecule
19687
organic cyclic compound
19498
organic aromatic compound
19366
phenylpropanoid
11297
lignan
1705
rel-(7R,8R,7'R,8'R)-3',4'-methylenedioxy-3,4,5,5'-tetramethoxy-7,7'-epoxylignan
0