CHEBI:38953 - (+)-chimonanthine

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ChEBI Name (+)-chimonanthine
ChEBI ID CHEBI:38953
Definition The (3aR,3a'R,8aR,8a'R)-stereoisomer of chimonanthine.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C22H26N4
Net Charge 0
Average Mass 346.46880
Monoisotopic Mass 346.21575
InChI InChI=1S/C22H26N4/c1-25-13-11-21(15-7-3-5-9-17(15)23-19(21)25)22-12-14-26(2)20(22)24-18-10-6-4-8-16(18)22/h3-10,19-20,23-24H,11-14H2,1-2H3/t19-,20-,21+,22+/m1/s1
InChIKey HOYXPMHLHJOGHD-CZYKHXBRSA-N
SMILES [H][C@]12Nc3ccccc3[C@]1(CCN2C)[C@]12CCN(C)[C@@]1([H])Nc1ccccc21
Roles Classification
Biological Role(s): plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
(via calycanthaceous alkaloid )
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via alkaloid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing (+)-chimonanthine (CHEBI:38953) is a chimonanthine (CHEBI:38955)
(+)-chimonanthine (CHEBI:38953) is enantiomer of (−)-chimonanthine (CHEBI:87)
Incoming (+)-calycanthidine (CHEBI:3332) has functional parent (+)-chimonanthine (CHEBI:38953)
(+)-folicanthine (CHEBI:38973) has functional parent (+)-chimonanthine (CHEBI:38953)
(−)-chimonanthine (CHEBI:87) is enantiomer of (+)-chimonanthine (CHEBI:38953)
IUPAC Name
(3aR,3a'R,8aR,8a'R)-1,1'-dimethyl-2,2',3,3',8,8',8a,8a'-octahydro-1H,1'H-3a,3a'-bipyrrolo[2,3-b]indole
Registry Numbers Types Sources
5142889 Beilstein Registry Number Beilstein
578995 Beilstein Registry Number Beilstein
Last Modified
29 January 2015