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ID	http://purl.obolibrary.org/obo/CHEBI_40968 http://purl.obolibrary.org/obo/CHEBI_40968 https://agroportal.lirmm.fr/ontologies/CDNO/CHEBI_40968 Loading
Preferred name	astaxanthin
Synonyms	ASTAXANTHIN Astaxanthin (3S,3'S)-3,3'-dihydroxy-beta,beta-carotene-4,4'-dione (3S,3'S)-astaxanthin 3,3'-dihydroxy-beta,beta-carotene-4,4'-dione 3,3'-dihydroxy-beta-carotene-4,4'-dione E 161j all-trans-(3S,3'S)-astaxanthin astaxanthine ovoester See more See less
Definitions	A carotenone that consists of beta,beta-carotene-4,4'-dione bearing two hydroxy substituents at positions 3 and 3' (the 3S,3'S diastereomer). A carotenoid pigment found mainly in animals (crustaceans, echinoderms) but also occurring in plants. It can occur free (as a red pigment), as an ester, or as a blue, brown or green chromoprotein.

rdf:type	http://www.w3.org/2002/07/owl#Class Loading
rdfs:subClassOf	http://purl.obolibrary.org/obo/CHEBI_27325 Loading
rdfs:label	astaxanthin
skos:notation	CHEBI:40968
obo_purl:IAO_0000115	A carotenone that consists of beta,beta-carotene-4,4'-dione bearing two hydroxy substituents at positions 3 and 3' (the 3S,3'S diastereomer). A carotenoid pigment found mainly in animals (crustaceans, echinoderms) but also occurring in plants. It can occur free (as a red pigment), as an ester, or as a blue, brown or green chromoprotein.
oboinowl_gen:hasExactSynonym	ASTAXANTHIN Astaxanthin (3S,3'S)-3,3'-dihydroxy-beta,beta-carotene-4,4'-dione
oboinowl_gen:hasDbXref	Beilstein:1917937 CAS:472-61-7 COMe:MOL000055 HMDB:HMDB0002204 KEGG:C08580 KNApSAcK:C00000918 LIPID_MAPS_instance:LMPR01070263 PDBeChem:AXT PMID:21833799 PMID:21883294 PMID:22119431 PMID:22188802 PMID:22189778 PMID:22221991 PMID:22267192 PMID:22279065 PMID:22309505 PMID:22349894 PMID:22406426 PMID:22428137 PMID:22432539 PMID:22455145 Reaxys:1917937 Wikipedia:Astaxanthin See more See less
oboinowl_gen:hasOBONamespace	chebi_ontology
oboinowl_gen:id	CHEBI:40968
oboinowl_gen:inSubset	http://purl.obolibrary.org/obo/chebi#3_STAR Loading
oboinowl_gen:hasRelatedSynonym	(3S,3'S)-astaxanthin 3,3'-dihydroxy-beta,beta-carotene-4,4'-dione 3,3'-dihydroxy-beta-carotene-4,4'-dione E 161j all-trans-(3S,3'S)-astaxanthin astaxanthine ovoester See more See less
oboinowl_gen:hasAlternativeId	CHEBI:2895 CHEBI:40963
obo_purl:charge	0
obo_purl:formula	C40H52O4
obo_purl:inchi	InChI=1S/C40H52O4/c1-27(17-13-19-29(3)21-23-33-31(5)37(43)35(41)25-39(33,7)8)15-11-12-16-28(2)18-14-20-30(4)22-24-34-32(6)38(44)36(42)26-40(34,9)10/h11-24,35-36,41-42H,25-26H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,27-15+,28-16+,29-19+,30-20+/t35-,36-/m0/s1
obo_purl:inchikey	MQZIGYBFDRPAKN-UWFIBFSHSA-N
obo_purl:mass	596.83848
obo_purl:monoisotopicmass	596.38656
obo_purl:smiles	CC(\C=C\C=C(C)\C=C\C1=C(C)C(=O)[C@@H](O)CC1(C)C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C1=C(C)C(=O)[C@@H](O)CC1(C)C

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