CHEBI:540787 - reynosin

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ChEBI Name reynosin
ChEBI ID CHEBI:540787
Definition A sesquiterpene lactone of the eudesmanolide group, found particularly in Magnolia grandiflora and Laurus nobilis.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:66301
Supplier Information
Download Molfile XML SDF
Formula C15H20O3
Net Charge 0
Average Mass 248.31750
Monoisotopic Mass 248.14124
InChI InChI=1S/C15H20O3/c1-8-4-5-11(16)15(3)7-6-10-9(2)14(17)18-13(10)12(8)15/h10-13,16H,1-2,4-7H2,3H3/t10-,11+,12+,13-,15-/m0/s1
InChIKey FKBUODICGDOIGB-PFFFPCNUSA-N
SMILES [H][C@@]12CC[C@@]3(C)[C@H](O)CCC(=C)[C@]3([H])[C@@]1([H])OC(=O)C2=C
Metabolite of Species Details
Ambrosia confertiflora (IPNI:11051-2) See: PubMed
Saussurea lappa (NCBI:txidtxid324593) See: PubMed
Magnolia grandiflora (NCBI:txidtxid3406) See: PubMed
Laurus nobilis (NCBI:txidtxid85223) Found in leaf (BTO:0000713). See: DOI
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing reynosin (CHEBI:540787) has role metabolite (CHEBI:25212)
reynosin (CHEBI:540787) is a organic heterotricyclic compound (CHEBI:26979)
reynosin (CHEBI:540787) is a sesquiterpene lactone (CHEBI:37667)
IUPAC Name
(3aS,5aR,6R,9aS,9bS)-6-hydroxy-5a-methyl-3,9-bis(methylene)decahydronaphtho[1,2-b]furan-2(3H)-one
Synonyms Sources
(+)-reynosin ChEBI
(3aS)-3a,4,5,5a,6,7,8,9,9aβ,9bα-decahydro-6α-hydroxy-5aα-methyl-3,9-bis(methylene)naphtho[1,2-b]furan-2(3H)-one ChEBI
(3aS,9aβ,9bα)-3a,4,5,5a,6,7,8,9,9a,9b-decahydro-6α-hydroxy-5aα-methyl-3,9-bis(methylene)naphtho[1,2-b]furan-2(3H)-one ChEBI
Registry Numbers Types Sources
1621245 Reaxys Registry Number Reaxys
28254-53-7 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
14660007 PubMed citation Europe PMC
641720 PubMed citation Europe PMC
6476889 PubMed citation Europe PMC
9690347 PubMed citation Europe PMC
Last Modified
24 September 2014