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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:adonixanthin
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Accession:CHEBI:80217 term browser browse the term
Definition:A carotenone that consists of beta,beta-caroten-4-one bearing two hydroxy substituents at positions 3 and 3' (the 3S,3'R diastereomer).
Synonyms:exact_synonym: (3S,3'R)-3,3'-dihydroxy-beta,beta-caroten-4-one
 related_synonym: (3S,3'R)-4-ketozeaxanthin;   (3S,3'R)-adonixanthin;   (3S,3'R)-dihydroxy-4-keto-beta,beta-carotene;   4-Ketozeaxanthin;   Formula=C40H54O3;   InChI=1S/C40H54O3/c1-28(17-13-19-30(3)21-23-35-32(5)25-34(41)26-39(35,7)8)15-11-12-16-29(2)18-14-20-31(4)22-24-36-33(6)38(43)37(42)27-40(36,9)10/h11-24,34,37,41-42H,25-27H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,28-15+,29-16+,30-19+,31-20+/t34-,37+/m1/s1;   InChIKey=YECXHLPYMXGEBI-ZNQVSPAOSA-N;   SMILES=C=1(C(C[C@@H](C(C1C)=O)O)(C)C)/C=C/C(=C/C=C/C(=C/C=C/C=C(/C=C/C=C(/C=C/C=2C(C[C@@H](CC2C)O)(C)C)\\C)\\C)/C)/C;   all-trans-adonixanthin;   all-trans-beta-doradexanthin;   doradexanthin
 xref: CAS:4418-73-9;   KEGG:C15968;   KNApSAcK:C00000917;   LIPID_MAPS_instance:LMPR01070016;   MetaCyc:CPD-7852;   PMID:15272869;   PMID:22669477;   PMID:23470446;   PMID:28689962;   PMID:29439525;   PMID:29502828;   PMID:30092231;   Reaxys:6494355

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