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: 2-[(3R,6aR,8S,10aR)-3-hydroxy-1-[oxo(pyridin-4-yl)methyl]-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-(4-phenylphenyl)acetamide
Accession: CHEBI:129387
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Definition: A biphenyl that has formula C29H31N3O5.
Synonyms: related_synonym: Formula=C29H31N3O5; InChI=1S/C29H31N3O5/c33-24-17-32(29(35)22-12-14-30-15-13-22)26-11-10-25(37-27(26)19-36-18-24)16-28(34)31-23-8-6-21(7-9-23)20-4-2-1-3-5-20/h1-9,12-15,24-27,33H,10-11,16-19H2,(H,31,34)/t24-,25+,26-,27+/m1/s1; InChIKey=HNNNEJGNUHWGOR-RAVGUYNFSA-N; SMILES=C1C[C@@H]2[C@H](COC[C@@H](CN2C(=O)C3=CC=NC=C3)O)O[C@@H]1CC(=O)NC4=CC=C(C=C4)C5=CC=CC=C5
xref: LINCS:LSM-40938
Term paths to the root one shortest all shortest one longest all longest one shortest and longest all
Path 1
CHEBI ontology
499
chemical entity
499
molecular entity
499
polyatomic entity
492
molecule
473
cyclic compound
454
ring assembly
3
biphenyls
3
2-[(3R,6aR,8S,10aR)-3-hydroxy-1-[oxo(pyridin-4-yl)methyl]-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-(4-phenylphenyl)acetamide
0
Path 2
CHEBI ontology
499
subatomic particle
499
composite particle
499
hadron
499
baryon
499
nucleon
499
atomic nucleus
499
atom
499
main group element atom
492
p-block element atom
492
carbon group element atom
481
carbon atom
480
organic molecular entity
480
organic molecule
471
organic cyclic compound
454
carbocyclic compound
193
benzenoid aromatic compound
191
biphenyls
3
2-[(3R,6aR,8S,10aR)-3-hydroxy-1-[oxo(pyridin-4-yl)methyl]-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-(4-phenylphenyl)acetamide
0