CHEBI:65035 - festuclavine

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ChEBI Name festuclavine
ChEBI ID CHEBI:65035
Definition An alkaloid that is the 6,8β-dimethyl derivative of ergoline.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter KAX
Supplier Information
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Formula C16H20N2
Net Charge 0
Average Mass 240.34340
Monoisotopic Mass 240.16265
InChI InChI=1S/C16H20N2/c1-10-6-13-12-4-3-5-14-16(12)11(8-17-14)7-15(13)18(2)9-10/h3-5,8,10,13,15,17H,6-7,9H2,1-2H3/t10-,13-,15-/m1/s1
InChIKey VLMZMRDOMOGGFA-WDBKCZKBSA-N
SMILES [H][C@@]12Cc3c[nH]c4cccc(c34)[C@@]1([H])C[C@@H](C)CN2C
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.
(via alkaloid )
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ChEBI Ontology
Outgoing festuclavine (CHEBI:65035) has parent hydride ergoline (CHEBI:38484)
festuclavine (CHEBI:65035) is a ergot alkaloid (CHEBI:23943)
festuclavine (CHEBI:65035) is conjugate base of festuclavine(1+) (CHEBI:65045)
Incoming festuclavine(1+) (CHEBI:65045) is conjugate acid of festuclavine (CHEBI:65035)
IUPAC Name
(8β)-6,8-dimethylergoline
Synonyms Sources
(8-beta)-6,8-Dimethylergoline ChemIDplus
6,8-beta-Dimethylergoline ChemIDplus
Festuclavin ChemIDplus
Manual Xrefs Databases
EP0189430 Patent
WO8505634 Patent
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Registry Numbers Types Sources
569-26-6 CAS Registry Number ChemIDplus
87764 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
11357427 PubMed citation Europe PMC
19382708 PubMed citation Europe PMC
20435769 PubMed citation Europe PMC
20526482 PubMed citation SUBMITTER
20735127 PubMed citation Europe PMC
21409592 PubMed citation Europe PMC
21494745 PubMed citation Europe PMC
21898587 PubMed citation Europe PMC
2328483 PubMed citation Europe PMC
4018228 PubMed citation Europe PMC
7084822 PubMed citation Europe PMC
Last Modified
25 June 2012