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CHEBI:62743 - 4,4'-diaponeurosporene

ChEBI IDCHEBI:62743
ChEBI Name4,4'-diaponeurosporene
Stars
DefinitionAn apo carotenoid triterpenoid that is tetracosane which is substituted by methyl groups at positions 2, 6, 10, 15, 19, and 23, and contains double bonds at the 2-3 and 22-23 positions, and E-double bonds at the 4-5, 6-7, 8-9, 10-11, 12-13, 14-15, 16-17, and 18-19 positions. It is a yellow carotenoid pigment of Staphylococcus aureus.
Last Modified28 July 2014
SubmitterGareth Owen
DownloadsMolfile
FormulaC30H42
Net Charge0
Average Mass402.666
Monoisotopic Mass402.32865
SMILESCC(C)=C/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(\C)CCC=C(C)C
InChIInChI=1S/C30H42/c1-25(2)15-11-19-29(7)23-13-21-27(5)17-9-10-18-28(6)22-14-24-30(8)20-12-16-26(3)4/h9-11,13-19,21-24H,12,20H2,1-8H3/b10-9+,19-11+,21-13+,22-14+,27-17+,28-18+,29-23+,30-24+
InChIKeyFPSYVUBUILNSRF-MQMKOTMBSA-N
ChEBI Ontology
Outgoing Relation(s)
4,4'-diaponeurosporene (CHEBI:62743) is a apo carotenoid triterpenoid (CHEBI:36783)
4,4'-diaponeurosporene (CHEBI:62743) is a polyene (CHEBI:48121)
4,4'-diaponeurosporene (CHEBI:62743) is a triterpene (CHEBI:35191)
IUPAC Name 
(4E,6E,8E,10E,12E,14E,16E,18E)-2,6,10,15,19,23-hexamethyltetracosa-2,4,6,8,10,12,14,16,18,22-decaene
Synonym  Source
all-trans-4,4'-diaponeurosporeneChEBI
UniProt Name  Source
all-trans-4,4'-diaponeurosporeneUniProt
Manual XrefsDatabases
C16145KEGG COMPOUND
CPD-9911MetaCyc
C00023134KNApSAcK
Registry NumbersSources
Reaxys:2280899Reaxys
CAS:53872-50-7ChemIDplus
CAS:53872-50-7KEGG COMPOUND
Citations