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-[(1R,3R,4aS,9aR)-6-(benzenesulfonamido)-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-(cyclopropylmethyl)acetamide
Accession: CHEBI:117547
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Definition: A sulfonamide that has formula C24H28N2O6S.
Synonyms: related_synonym: Formula=C24H28N2O6S; InChI=1S/C24H28N2O6S/c27-14-22-24-20(11-17(31-22)12-23(28)25-13-15-6-7-15)19-10-16(8-9-21(19)32-24)26-33(29,30)18-4-2-1-3-5-18/h1-5,8-10,15,17,20,22,24,26-27H,6-7,11-14H2,(H,25,28)/t17-,20+,22-,24-/m1/s1; InChIKey=UITZQDWRSZBATF-LWSJSWBQSA-N; SMILES=C1CC1CNC(=O)C[C@H]2C[C@@H]3[C@H]([C@H](O2)CO)OC4=C3C=C(C=C4)NS(=O)(=O)C5=CC=CC=C5
xref: LINCS:LSM-28996
Term paths to the root one shortest all shortest one longest all longest one shortest and longest all
Path 1
CHEBI ontology
19831
chemical entity
19829
atom
19829
nonmetal atom
19767
sulfur atom
17707
sulfur molecular entity
17707
organosulfur compound
17352
sulfonamide
5300
2-[(1R,3R,4aS,9aR)-6-(benzenesulfonamido)-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-(cyclopropylmethyl)acetamide
0
Path 2
CHEBI ontology
19831
subatomic particle
19829
composite particle
19829
hadron
19829
baryon
19829
nucleon
19829
atomic nucleus
19829
atom
19829
main group element atom
19779
p-block element atom
19779
chalcogen
19534
oxygen atom
19509
oxygen molecular entity
19509
hydroxides
19320
oxoacid
18744
chalcogen oxoacid
13770
sulfur oxoacid
13558
sulfonic acid
11598
sulfonic acid derivative
11598
sulfonamide
5300
2-[(1R,3R,4aS,9aR)-6-(benzenesulfonamido)-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-(cyclopropylmethyl)acetamide
0