ginsenoside C-Y (CHEBI:77157)

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CHEBI:77157 - ginsenoside C-Y

ChEBI ID	CHEBI:77157
ChEBI Name	ginsenoside C-Y
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 α-L-arabinopyranosyl-(1→6)-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	C41H70O12
Net Charge	0
Average Mass	754.999
Monoisotopic Mass	754.48673
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]5OC[C@H](O)[C@H](O)[C@H]5O)[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/C41H70O12/c1-21(2)10-9-14-41(8,53-36-34(49)32(47)31(46)25(52-36)20-51-35-33(48)30(45)24(43)19-50-35)22-11-16-40(7)29(22)23(42)18-27-38(5)15-13-28(44)37(3,4)26(38)12-17-39(27,40)6/h10,22-36,42-49H,9,11-20H2,1-8H3/t22-,23+,24-,25+,26-,27+,28-,29-,30-,31+,32-,33+,34+,35-,36-,38-,39+,40+,41-/m0/s1
InChIKey	YNBYFOIDLBTOMW-QHNUHGIDSA-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.

ChEBI Ontology

Outgoing Relation(s)
	ginsenoside C-Y (CHEBI:77157) has parent hydride dammarane (CHEBI:36488)
	ginsenoside C-Y (CHEBI:77157) has role plant metabolite (CHEBI:76924)
	ginsenoside C-Y (CHEBI:77157) is a 12β-hydroxy steroid (CHEBI:36847)
	ginsenoside C-Y (CHEBI:77157) is a 3β-hydroxy steroid (CHEBI:36836)
	ginsenoside C-Y (CHEBI:77157) is a 3β-hydroxy-4,4-dimethylsteroid (CHEBI:143563)
	ginsenoside C-Y (CHEBI:77157) is a disaccharide derivative (CHEBI:63353)
	ginsenoside C-Y (CHEBI:77157) is a ginsenoside (CHEBI:74978)
	ginsenoside C-Y (CHEBI:77157) is a tetracyclic triterpenoid (CHEBI:26893)
	ginsenoside C-Y (CHEBI:77157) is a β-D-glucoside (CHEBI:22798)

IUPAC Name
(β,12β)-3,12-dihydroxydammar-24-en-20-yl 6-O-α-L-arabinopyranosyl-β-D-glucopyranoside

Synonyms	Source
ginsenoside Y	ChEBI
ginsenoside compound Y	ChEBI

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

Manual Xrefs	Databases
CPD-15457	MetaCyc

Registry Numbers	Sources
Reaxys:5696805	Reaxys

Citations