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: (14S,16S,2R,3E,5E,12S,13E)-84-chloro-14,85-dihydroxy-2-methoxy-6,13,15-trimethyl-12,10-dioxo-9-aza-1(4,6)-oxazinana-8(1,3)-benzenacyclopentadecaphane-3,5,13-trien-12-yl methylcarbamate
Accession: CHEBI:209919
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Synonyms: related_synonym: Formula=C28H36ClN3O8; InChI=1S/C28H36ClN3O8/c1-15-7-6-8-23(38-5)28(37)14-22(40-27(36)32-28)17(3)10-16(2)21(39-26(35)30-4)13-24(34)31-19-11-18(9-15)12-20(33)25(19)29/h6-8,10-12,17,21-23,33,37H,9,13-14H2,1-5H3,(H,30,35)(H,31,34)(H,32,36)/b8-6+,15-7+,16-10+/t17?,21-,22-,23+,28-/m0/s1; InChIKey=GFXLVPCOYQUFTO-MRNBBUSGSA-N; SMILES=ClC1=C(O)C=C2CC(=CC=C[C@@H](OC)[C@]3(O)NC(O[C@H](C(C=C([C@H](CC(NC1=C2)=O)OC(=O)NC)C)C)C3)=O)C
Term paths to the root one shortest all shortest one longest all longest one shortest and longest all
Path 1
CHEBI ontology
19904
chemical entity
19902
molecular entity
19901
polyatomic entity
19852
heteroatomic molecular entity
19809
hydroxides
19377
organic hydroxy compound
18984
phenols
18682
(14S,16S,2R,3E,5E,12S,13E)-84-chloro-14,85-dihydroxy-2-methoxy-6,13,15-trimethyl-12,10-dioxo-9-aza-1(4,6)-oxazinana-8(1,3)-benzenacyclopentadecaphane-3,5,13-trien-12-yl methylcarbamate
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Path 2
CHEBI ontology
19904
subatomic particle
19902
composite particle
19902
hadron
19902
baryon
19902
nucleon
19902
atomic nucleus
19902
atom
19902
main group element atom
19841
p-block element atom
19841
carbon group element atom
19779
carbon atom
19776
organic molecular entity
19776
organic molecule
19730
organic cyclic compound
19522
organic aromatic compound
19388
phenols
18682
(14S,16S,2R,3E,5E,12S,13E)-84-chloro-14,85-dihydroxy-2-methoxy-6,13,15-trimethyl-12,10-dioxo-9-aza-1(4,6)-oxazinana-8(1,3)-benzenacyclopentadecaphane-3,5,13-trien-12-yl methylcarbamate
0