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: [19-acetyloxy-2-hydroxy-7-(2-hydroxypropan-2-yl)-4,12,17,18,20-pentamethyl-23-oxo-8,13,16-trioxahexacyclo[12.9.0.03,12.04,9.015,18.015,21]tricosa-1(14),21-dien-5-yl] acetate
Accession: CHEBI:181313
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Synonyms: related_synonym: Formula=C32H44O10; InChI=1S/C32H44O10/c1-14-18-12-19(35)23-24(36)25-29(7,42-27(23)32(18)31(9,15(2)41-32)26(14)39-17(4)34)11-10-20-30(25,8)22(38-16(3)33)13-21(40-20)28(5,6)37/h12,14-15,20-22,24-26,36-37H,10-11,13H2,1-9H3; InChIKey=MPCIDUFOTGXABA-UHFFFAOYSA-N; SMILES=O1C23C(C(OC(=O)C)C(C2=CC(=O)C4=C3OC5(C(C6(C(OC(CC6OC(=O)C)C(O)(C)C)CC5)C)C4O)C)C)(C1C)C
Term paths to the root one shortest all shortest one longest all longest one shortest and longest all
Path 1
CHEBI ontology
19811
chemical entity
19840
atom
19809
nonmetal atom
19747
oxygen atom
19520
oxygen molecular entity
19490
organooxygen compound
19137
oxacycle
17819
[19-acetyloxy-2-hydroxy-7-(2-hydroxypropan-2-yl)-4,12,17,18,20-pentamethyl-23-oxo-8,13,16-trioxahexacyclo[12.9.0.03,12.04,9.015,18.015,21]tricosa-1(14),21-dien-5-yl] acetate
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Path 2
CHEBI ontology
19811
subatomic particle
19809
composite particle
19809
hadron
19840
baryon
19809
nucleon
19809
atomic nucleus
19809
atom
19809
main group element atom
19759
p-block element atom
19759
carbon group element atom
19708
carbon atom
19734
organic molecular entity
19705
organic molecule
19658
organic cyclic compound
19471
organic heterocyclic compound
18862
oxacycle
17819
[19-acetyloxy-2-hydroxy-7-(2-hydroxypropan-2-yl)-4,12,17,18,20-pentamethyl-23-oxo-8,13,16-trioxahexacyclo[12.9.0.03,12.04,9.015,18.015,21]tricosa-1(14),21-dien-5-yl] acetate
0