Naringin | MMP-AC0149

	Compound Name :	Naringin
	Compound Class :	Flavonoid
	Synonyms :	naringin; 10236-47-2; Naringoside; Naringin hydrate; UNII-N7TD9J649B;
	Compound Extracted from :	Naringin is extracted / reported from 3 Plant(s) of Melghat Flora as below MH067: Vigna radiata (L.) R. Wilczek; MH132: Sonchus oleraceus L.; MS041: Moghania bracteata (Roxb.) H.L.Li;

	Molecular Formula :	C27H32O14
	Molecular Weight :	580.5
	InChi Key :	DFPMSGMNTNDNHN-ZPHOTFPESA-N
	IUPAC :	(2S)-7-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one
	InChi :	InChI=1S/C27H32O14/c1-10-20(32)22(34)24(36)26(37-10)41-25-23(35)21(33)18(9-28)40-27(25)38-13-6-14(30)19-15(31)8-16(39-17(19)7-13)11-2-4-12(29)5-3-11/h2-7,10,16,18,20-30,32-36H,8-9H2,1H3/t10-,16-,18+,20-,21+,22+,23-,24+,25+,26-,27+/m0/s1
	Hydrogen Bond Donor count :	8
	Hydrogen Bond Acceptor count :	14
	Rotational Bond count :	6
	TPSA :	225
	LogP Value :	-0.5

	Lipinski Rule of Five :	No
	Ghose Filter :	No
	Veber Filter :	No
	Muegge Filter :	No

	PubChem CID :	442428
	Drugbank ID :	-
	Super Natural :	000480411
	CTD :	C005274
	HIT :	C0352
	NCI-60 GI50 data :	-

	Reference(s) :	https://www.ncbi.nlm.nih.gov/pubmed/29510123

Compound_ID	Cell Lines	Cancer Type	IC50 Value	EC50 Value	ED50 Value	GI50 Value	References
MMP-AC0149	CCRF-HSB-2	Haematopoietic and Lymphoid tissue	>40 然	-	-	-	10380632
MMP-AC0149	A549	Lung	>40 然	-	-	-	10380632
MMP-AC0149	B16 melanoma 4A5	Skin	>40 然	-	-	-	10380632
MMP-AC0149	TGBC11TKB	Stomach	>40 然	-	-	-	10380632

Compound_ID	Target	Gene_Name	Gene_ID	Cancer	Cell_lines	IC50 Value	EC50 Value	ED50 Value	GI50 Value	Remarks	References
MMP-AC0149	BAX	BCL2-associated X protein	581	Gastric Cancer	AGS	-	-	-	-	Western blot results showed that expression level of Bax was increased in a dose-dependent manner.	22194772
MMP-AC0149	BCL2L1	BCL2-like 1	598	Gastric Cancer	AGS	-	-	-	-	Western blot results showed that expression level of Bcl-xL was decreased in a dose-dependent manner.	22194772
MMP-AC0149	CASP3	caspase 3, apoptosis-related cysteine peptidase	836	Gastric Cancer	AGS	-	-	-	-	Flavonoids caused downregulation of procaspase-3 which consequently increased the activity of caspase-3.	22194772
MMP-AC0149	CCNB1	cyclin B1	891	Gastric Cancer	AGS	-	-	-	-	It reduces the protein level of cyclin B1 in a dose-dependent manner.Decrease of cyclin B1 expression might be a molecular mechanism through which flavonoids induce G2/M arrest.	22194772
MMP-AC0149	CDC25C	cell division cycle 25 homolog C (S. pombe)	995	Gastric Cancer	AGS	-	-	-	-	It reduces the protein level of cdc 25c in a dose-dependent manner.Decrease of cdc 25c expression might be a molecular mechanism through which flavonoids induce G2/M arrest.	22194772
MMP-AC0149	CDK1	cyclin-dependent kinase 1	983	Gastric Cancer	AGS	-	-	-	-	It reduces the protein level of cdc 2 in a dose-dependent manner.Decrease of cdc 2 expression might be a molecular mechanism through which flavonoids induce G2/M arrest.	22194772
MMP-AC0149	PARP1	poly (ADP-ribose) polymerase 1	142	Gastric Cancer	AGS	-	-	-	-	During apoptosis, caspases induce PARP cleavage and inactivation and cleavage of PARP helps cellular disassembly and is a marker of cells undergoing apoptosis.	22194772
MMP-AC0149	TOP2A	topoisomerase (DNA) II alpha 170kDa	7153	Breast adenocarcinoma	MCF-7	>50 然	-	-	-	Tiliroside more effective against topoisomerase II than topoisomrase I. It is possible that tiliroside induce conformational DNA changes and hinder the formation of enzyme-DNA cleavable complexes. It induces both apoptosis and necrosis in breast cancer MCF-7 cells. The apoptotic cell death was observed for Tiliroside (44-46%) in a concentration range of 10 to 100然.	18557426

MMP-AC0149 : Naringin