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CHEBI:53163 - (3R)-3-hydroxy-12'-apo-β-carotenol

ChEBI IDCHEBI:53163
ChEBI Name(3R)-3-hydroxy-12'-apo-β-carotenol
Stars
ASCII Name(3R)-3-hydroxy-12'-apo-beta-carotenol
DefinitionThe (R-enantiomer of an apo carotenoid C25 terpenoid compound consisting of 12'-apo-β-carotene having hydroxy substituents at the 3- and 12'-positions.
Last Modified29 September 2009
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC25H36O2
Net Charge0
Average Mass368.561
Monoisotopic Mass368.27153
SMILESCC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(\C)CO)C(C)(C)C[C@H](O)C1
InChIInChI=1S/C25H36O2/c1-19(10-7-8-11-21(3)18-26)12-9-13-20(2)14-15-24-22(4)16-23(27)17-25(24,5)6/h7-15,23,26-27H,16-18H2,1-6H3/b8-7+,12-9+,15-14+,19-10+,20-13+,21-11+/t23-/m1/s1
InChIKeyXVQDCCGQSOTQBN-HEZGKBSMSA-N
ChEBI Ontology
Outgoing Relation(s)
(3R)-3-hydroxy-12'-apo-β-carotenol (CHEBI:53163) is a apo carotenoid C25 terpenoid (CHEBI:53184)
IUPAC Name 
(3R)-12'-apo-β-caroten-3,12'-diol
Registry NumbersSources
Beilstein:6525829Beilstein