ginsenoside C-K (CHEBI:77146)

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CHEBI:77146 - ginsenoside C-K

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ChEBI ID	CHEBI:77146
ChEBI Name	ginsenoside C-K
Stars
Definition	A ginsenoside found in Panax species that is dammarane which is substituted by hydroxy groups at the 3β, 12β and 20 pro-S positions, in which the hydroxy group at position 20 has been converted to the corresponding β-D-glucopyranoside, and in which a double bond has been introduced at the 24-25 position.
Last Modified	5 November 2019
Submitter	KAX
Downloads	Molfile

Formula	C36H62O8
Net Charge	0
Average Mass	622.884
Monoisotopic Mass	622.44447
SMILES	[H][C@]12C[C@@H](O)[C@]3([H])[C@@]([H])([C@](C)(CCC=C(C)C)O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)CC[C@@]3(C)[C@]1(C)CC[C@@]1([H])C(C)(C)[C@@H](O)CC[C@]21C
InChI	InChI=1S/C36H62O8/c1-20(2)10-9-14-36(8,44-31-30(42)29(41)28(40)23(19-37)43-31)21-11-16-35(7)27(21)22(38)18-25-33(5)15-13-26(39)32(3,4)24(33)12-17-34(25,35)6/h10,21-31,37-42H,9,11-19H2,1-8H3/t21-,22+,23+,24-,25+,26-,27-,28+,29-,30+,31-,33-,34+,35+,36-/m0/s1
InChIKey	FVIZARNDLVOMSU-IRFFNABBSA-N

Roles Classification

Biological Roles:	plant metabolite Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms. metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
Applications:	anti-inflammatory agent Any compound that has anti-inflammatory effects. anti-allergic agent A drug used to treat allergic reactions. hepatoprotective agent Any compound that is able to prevent damage to the liver. antineoplastic agent A substance that inhibits or prevents the proliferation of neoplasms.

ChEBI Ontology

Outgoing Relation(s)
	ginsenoside C-K (CHEBI:77146) has parent hydride dammarane (CHEBI:36488)
	ginsenoside C-K (CHEBI:77146) has role anti-allergic agent (CHEBI:50857)
	ginsenoside C-K (CHEBI:77146) has role anti-inflammatory agent (CHEBI:67079)
	ginsenoside C-K (CHEBI:77146) has role antineoplastic agent (CHEBI:35610)
	ginsenoside C-K (CHEBI:77146) has role hepatoprotective agent (CHEBI:62868)
	ginsenoside C-K (CHEBI:77146) has role plant metabolite (CHEBI:76924)
	ginsenoside C-K (CHEBI:77146) is a 12β-hydroxy steroid (CHEBI:36847)
	ginsenoside C-K (CHEBI:77146) is a 3β-hydroxy steroid (CHEBI:36836)
	ginsenoside C-K (CHEBI:77146) is a 3β-hydroxy-4,4-dimethylsteroid (CHEBI:143563)
	ginsenoside C-K (CHEBI:77146) is a ginsenoside (CHEBI:74978)
	ginsenoside C-K (CHEBI:77146) is a tetracyclic triterpenoid (CHEBI:26893)
	ginsenoside C-K (CHEBI:77146) is a β-D-glucoside (CHEBI:22798)

IUPAC Name
(3β,12β)-3,12-dihydroxydammar-24-en-20-yl β-D-glucopyranoside

Synonyms	Source
20β-(β-D-glucopyranosyloxy)dammar-24-ene-3β,12β-diol	SUBMITTER
ginsenoside compound K	ChEBI

UniProt Name	Source
(20S)-ginsenoside C-K	UniProt

Manual Xrefs	Databases
CPD-15450	MetaCyc
KR20110057895	Patent
KR20110073699	Patent
KR20110087900	Patent
KR20110113228	Patent
US2011212909	Patent
WO2008034328	Patent
WO2010045787	Patent

Registry Numbers	Sources
Reaxys:5785005	Reaxys

Citations