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CHEBI:18657 - (R)-2-trans-abscisic acid

ChEBI IDCHEBI:18657
ChEBI Name(R)-2-trans-abscisic acid
Stars
ASCII Name(R)-2-trans-abscisic acid
DefinitionA 2-trans-abscisic acid with (R)-configuration at the chiral centre.
Last Modified24 June 2011
DownloadsMolfile
FormulaC15H20O4
Net Charge0
Average Mass264.321
Monoisotopic Mass264.13616
SMILESCC1=CC(=O)CC(C)(C)[C@]1(O)/C=C/C(C)=C/C(=O)O
InChIInChI=1S/C15H20O4/c1-10(7-13(17)18)5-6-15(19)11(2)8-12(16)9-14(15,3)4/h5-8,19H,9H2,1-4H3,(H,17,18)/b6-5+,10-7+/t15-/m0/s1
InChIKeyJLIDBLDQVAYHNE-XQFZKXHBSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
(R)-2-trans-abscisic acid (CHEBI:18657) is a 2-trans-abscisic acid (CHEBI:62426)
(R)-2-trans-abscisic acid (CHEBI:18657) is conjugate acid of (R)-2-trans-abscisate (CHEBI:62433)
(R)-2-trans-abscisic acid (CHEBI:18657) is enantiomer of (S)-2-trans-abscisic acid (CHEBI:18743)
Incoming Relation(s)
(R)-2-trans-abscisate (CHEBI:62433) is conjugate base of (R)-2-trans-abscisic acid (CHEBI:18657)
(S)-2-trans-abscisic acid (CHEBI:18743) is enantiomer of (R)-2-trans-abscisic acid (CHEBI:18657)
IUPAC Name 
(2E,4E)-5-[(1R)-1-hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl]-3-methylpenta-2,4-dienoic acid
Synonym  Source
(7E,9E)-(6R)-6-hydroxy-3-oxo-11-apo-ε-caroten-11-oic acidJCBN
Registry NumbersSources
Beilstein:3034277Beilstein