hookerianamide K (CHEBI:66023)

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CHEBI:66023 - hookerianamide K

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ChEBI ID	CHEBI:66023
ChEBI Name	hookerianamide K
Stars
Definition	A steroid alkaloid that is pregn-4,14-diene substituted by N-dimethylamino groups at positions 3 and 20 (the 3β,20S stereoisomer). Isolated from Sarcococca hookeriana, it exhibits antileishmanial and antibacterial activities.
Last Modified	20 February 2013
Downloads	Molfile

Formula	C25H42N2
Net Charge	0
Average Mass	370.625
Monoisotopic Mass	370.33480
SMILES	[H][C@]12CC[C@@]3(C)C(=CC[C@]3([H])[C@H](C)N(C)C)[C@]1([H])CCC1=C[C@@H](N(C)C)CC[C@@]12C
InChI	InChI=1S/C25H42N2/c1-17(26(4)5)21-10-11-22-20-9-8-18-16-19(27(6)7)12-14-24(18,2)23(20)13-15-25(21,22)3/h11,16-17,19-21,23H,8-10,12-15H2,1-7H3/t17-,19-,20-,21+,23-,24-,25+/m0/s1
InChIKey	JLDLXPZTQHZTBT-JYNQZMPESA-N

Species of Metabolite	Component	Source	Comments
Sarcococca hookeriana (ncbitaxon:153579)	whole plant (BTO:0001461)	PubMed (18681480)

Roles Classification

Chemical Role:	Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Roles:	metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites. antileishmanial agent An antiprotozoal drug used to treat or prevent infections caused by protozoan parasites that belong to the genus Leishmania. EC 3.1.1.8 (cholinesterase) inhibitor An EC 3.1.1.* (carboxylic ester hydrolase) inhibitor that interferes with the action of cholinesterase (EC 3.1.1.8). antibacterial agent A substance (or active part thereof) that kills or slows the growth of bacteria. metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
Application:	antileishmanial agent An antiprotozoal drug used to treat or prevent infections caused by protozoan parasites that belong to the genus Leishmania.

ChEBI Ontology

Outgoing Relation(s)
	hookerianamide K (CHEBI:66023) has parent hydride pregnane (CHEBI:8386)
	hookerianamide K (CHEBI:66023) has role antibacterial agent (CHEBI:33282)
	hookerianamide K (CHEBI:66023) has role antileishmanial agent (CHEBI:70868)
	hookerianamide K (CHEBI:66023) has role EC 3.1.1.8 (cholinesterase) inhibitor (CHEBI:37733)
	hookerianamide K (CHEBI:66023) has role metabolite (CHEBI:25212)
	hookerianamide K (CHEBI:66023) is a steroid alkaloid (CHEBI:26767)
	hookerianamide K (CHEBI:66023) is a tertiary amino compound (CHEBI:50996)

IUPAC Name
(3β,20S)-N³,N³,N²⁰,N²⁰-tetramethylpregna-4,14-diene-3,20-diamine

Synonym	Source
(20S)-20-(N-dimethylamino)-3β-(N-dimethylamino)-pregn-4,14-diene	ChEBI

Registry Numbers	Sources
Reaxys:18885919	Reaxys

Citations