EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:67188 - 9-cis-β-carotene

ChEBI IDCHEBI:67188
ChEBI Name9-cis-β-carotene
Stars
ASCII Name9-cis-beta-carotene
DefinitionA carotenoid having the structure of β-carotene but with a cis double bond at the 9,10-position.
Last Modified4 November 2019
SubmitterKAX
DownloadsMolfile
FormulaC40H56
Net Charge0
Average Mass536.888
Monoisotopic Mass536.43820
SMILESCC1=C(/C=C/C(C)=C\C=C\C(C)=C\C=C\C=C(C)\C=C\C=C(C)\C=C\C2=C(C)CCCC2(C)C)C(C)(C)CCC1
InChIInChI=1S/C40H56/c1-31(19-13-21-33(3)25-27-37-35(5)23-15-29-39(37,7)8)17-11-12-18-32(2)20-14-22-34(4)26-28-38-36(6)24-16-30-40(38,9)10/h11-14,17-22,25-28H,15-16,23-24,29-30H2,1-10H3/b12-11+,19-13+,20-14+,27-25+,28-26+,31-17+,32-18+,33-21-,34-22+
InChIKeyOENHQHLEOONYIE-BVZAMQQESA-N
Roles Classification
Biological Role:
biological pigment  An endogenous molecular entity that results in a colour of an organism as the consequence of the selective absorption of light.
ChEBI Ontology
Outgoing Relation(s)
9-cis-β-carotene (CHEBI:67188) has role biological pigment (CHEBI:26130)
9-cis-β-carotene (CHEBI:67188) is a carotenoid (CHEBI:23044)
IUPAC Name 
9-cis-β,β-carotene
Synonyms  Source
neo-β-carotene UChEBI
(9Z)-β-caroteneChEBI
UniProt Name  Source
9-cis-β-caroteneUniProt
Manual XrefsDatabases
CPD-14646MetaCyc
C20484KEGG COMPOUND
Citations