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Concept information

organooxygen compound > ether > carotenoid ether > 2'-hydroxy-2-oxospirilloxanthin

Preferred term

2'-hydroxy-2-oxospirilloxanthin  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

charge

  • 0

formula

  • C42H58O4

has_functional_parent

inchi

  • InChI=1S/C42H58O4/c1-33(21-15-23-35(3)25-17-27-37(5)29-31-39(43)41(7,8)45-11)19-13-14-20-34(2)22-16-24-36(4)26-18-28-38(6)30-32-40(44)42(9,10)46-12/h13-32,39,43H,1-12H3/b14-13+,21-15+,22-16+,25-17+,26-18+,31-29+,32-30+,33-19+,34-20+,35-23+,36-24+,37-27+,38-28+

inchikey

  • UMEYQXNKNUVLNE-YDDLGYPNSA-N

mass

  • 626.909

monoisotopicmass

  • 626.43351

smiles

  • C(=C(/C=C/C(C(OC)(C)C)O)/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(OC)(C)C)=O)/C)/C)/C)/C)/C

subset

  • 3_STAR

synonym EXACT

  • 2'-hydroxy-2-oxospirilloxanthin
  • (3E,3'E)-2'-hydroxy-1,1'-dimethoxy-3,3',4,4'-tetradehydro-1,1',2,2'-tetrahydro-psi,psi-caroten-2-one

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:91229

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