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: 6-methoxy-3,6a,9,10-tetrahydroxy-7,8-epoxy-4-oxo-4,5,6,6a,6b,7,8,9-octahydroperylene
Accession: CHEBI:215984
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Synonyms: exact_synonym: (9S,10S,11R,12R,14S,15R)-5,10,15,17-tetrahydroxy-9-methoxy-13-oxahexacyclo[9.8.1.12,6.012,14.016,20.010,21]henicosa-1(20),2(21),3,5,16,18-hexaen-7-one
related_synonym: Formula=C21H18O7; InChI=1S/C21H18O7/c1-27-12-6-11(24)14-9(22)5-3-8-7-2-4-10(23)15-13(7)17(21(12,26)16(8)14)19-20(28-19)18(15)25/h2-5,12,17-20,22-23,25-26H,6H2,1H3/t12-,17+,18+,19+,20-,21+/m0/s1; InChIKey=NVODHWKAAUNLFB-CMBVTXLXSA-N; SMILES=O=C1C2=C(O)C=CC3=C2[C@@](O)([C@H]4[C@H]5O[C@H]5[C@@H](C=6C4=C3C=CC6O)O)[C@H](C1)OC
xref: Chemspider:78442241
Term paths to the root one shortest all shortest one longest all longest one shortest and longest all
Path 1
CHEBI ontology
19921
role
19893
biological role
19891
xenobiotic
18774
phenanthrenes
303
6-methoxy-3,6a,9,10-tetrahydroxy-7,8-epoxy-4-oxo-4,5,6,6a,6b,7,8,9-octahydroperylene
0
Path 2
CHEBI ontology
19921
subatomic particle
19919
composite particle
19919
hadron
19919
baryon
19919
nucleon
19919
atomic nucleus
19919
atom
19919
main group element atom
19865
p-block element atom
19865
carbon group element atom
19804
carbon atom
19801
organic molecular entity
19801
organic molecule
19754
organic cyclic compound
19544
carbocyclic compound
18620
carbopolycyclic compound
17191
carbotricyclic compound
1561
phenanthrenes
303
6-methoxy-3,6a,9,10-tetrahydroxy-7,8-epoxy-4-oxo-4,5,6,6a,6b,7,8,9-octahydroperylene
0