CHEBI:53159 - (3R)-3-hydroxy-8'-apo-β-carotenal

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ChEBI Name (3R)-3-hydroxy-8'-apo-β-carotenal
ChEBI ID CHEBI:53159
ChEBI ASCII Name (3R)-3-hydroxy-8'-apo-beta-carotenal
Definition An apo carotenoid triterpenoid compound consisting of 8'-apo-β-carotene having an aldehyde group in the 8'-position and an (R)-hydroxy substituent at the 3-position.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Kristian Axelsen
Supplier Information
Download Molfile XML SDF
Formula C30H40O2
Net Charge 0
Average Mass 432.63740
Monoisotopic Mass 432.30283
InChI InChI=1S/C30H40O2/c1-23(12-8-9-13-24(2)15-11-17-26(4)22-31)14-10-16-25(3)18-19-29-27(5)20-28(32)21-30(29,6)7/h8-19,22,28,32H,20-21H2,1-7H3/b9-8+,14-10+,15-11+,19-18+,23-12+,24-13+,25-16+,26-17+/t28-/m1/s1
InChIKey AVPAEFHIEZLSLZ-QCPGYTKSSA-N
SMILES [H]C(=O)C(\C)=C\C=C\C(C)=C\C=C\C=C(C)\C=C\C=C(C)\C=C\C1=C(C)C[C@@H](O)CC1(C)C
Roles Classification
Biological Role(s): plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing (3R)-3-hydroxy-8'-apo-β-carotenal (CHEBI:53159) has role plant metabolite (CHEBI:76924)
(3R)-3-hydroxy-8'-apo-β-carotenal (CHEBI:53159) is a apo carotenoid triterpenoid (CHEBI:36783)
(3R)-3-hydroxy-8'-apo-β-carotenal (CHEBI:53159) is a enal (CHEBI:51688)
IUPAC Name
(3R)-3-hydroxy-8'-apo-β-caroten-8'-al
Synonyms Sources
(3R)-3-hydroxy-8'-apo-β-carotenal UniProt
apo-8'-zeaxanthinal ChEBI
β-citraurin ChEBI
Manual Xref Database
HMDB0035091 HMDB
View more database links
Registry Numbers Types Sources
2309631 Reaxys Registry Number Reaxys
2309631 Beilstein Registry Number Beilstein
7888297 Beilstein Registry Number Beilstein
Citations Waiting for Citations Types Sources
11312902 PubMed citation Europe PMC
16848534 PubMed citation Europe PMC
4387616 PubMed citation Europe PMC
IND21977971 Agricola citation Europe PMC
Last Modified
27 February 2014