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CHEBI:204708 - 3,4,3',4'-Tetrahydro-bisanhydrobacterioruberin

ChEBI IDCHEBI:204708
ChEBI Name3,4,3',4'-Tetrahydro-bisanhydrobacterioruberin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC50H76O2
Net Charge0
Average Mass709.156
Monoisotopic Mass708.58453
SMILESCC(C)=CCC(CC/C(C)=C/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C=C(\C)CCC(CC=C(C)C)C(C)(C)O)C(C)(C)O
InChIInChI=1S/C50H76O2/c1-39(2)31-35-47(49(11,12)51)37-33-45(9)29-19-27-43(7)25-17-23-41(5)21-15-16-22-42(6)24-18-26-44(8)28-20-30-46(10)34-38-48(50(13,14)52)36-32-40(3)4/h15-32,47-48,51-52H,33-38H2,1-14H3/b16-15+,23-17+,24-18+,27-19+,28-20+,41-21+,42-22+,43-25+,44-26+,45-29+,46-30+
InChIKeyYDHWOAQKEXVUAU-AJKRBSIJSA-N
Species of MetaboliteComponentSourceComments
Corynebacterium (ncbitaxon:1716) - DOI (10.1007/BF00416974)
ChEBI Ontology
Outgoing Relation(s)
3,4,3',4'-Tetrahydro-bisanhydrobacterioruberin (CHEBI:204708) is a xanthophyll (CHEBI:27325)
IUPAC Name 
(6E,8E,10E,12E,14E,16E,18E,20E,22E,24E,26E)-2,6,10,14,19,23,27,31-octamethyl-3,30-bis(3-methylbut-2-enyl)dotriaconta-6,8,10,12,14,16,18,20,22,24,26-undecaene-2,31-diol
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78435959ChemSpider