InterPAD - DETAILS

3',4',7-trihydroxyethylrutin, 3',4',7-tris(O-(2- hydroxyethyl))rutin, oxerutin, Paroven, Posorutin, Relvene, Rhéoflux, Teboven, Troxérutine Mazal, troxerutin, Troxerutin-ratiopharm, Troxeven, Vastribil, Veinamitol, Veniten retard, Veno SL, Venorutin, venoruton, venoruton P4, Venotrulan Trox, vitamin P4

No.	Title	Href
1	Troxerutin (TXN) potentiated 5-Fluorouracil (5-Fu) treatment of human gastric cancer through suppressing STAT3/NF-κB and Bcl-2 signaling pathways. Biomed Pharmacother. 2017 Aug;92:95-107. doi: 10.1016/j.biopha.2017.04.059.	`Click`

No.

Title

Href

Troxerutin (TXN) potentiated 5-Fluorouracil (5-Fu) treatment of human gastric cancer through suppressing STAT3/NF-κB and Bcl-2 signaling pathways. Biomed Pharmacother. 2017 Aug;92:95-107. doi: 10.1016/j.biopha.2017.04.059.

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Name	Troxerutin
PubChem CID	5486699
Molecular Weight	742.7g/mol
Synonyms	3',4',7-trihydroxyethylrutin, 3',4',7-tris(O-(2- hydroxyethyl))rutin, oxerutin, Paroven, Posorutin, Relvene, Rhéoflux, Teboven, Troxérutine Mazal, troxerutin, Troxerutin-ratiopharm, Troxeven, Vastribil, Veinamitol, Veniten retard, Veno SL, Venorutin, venoruton, venoruton P4, Venotrulan Trox, vitamin P4
Formula	C₃₃H₄₂O₁₉
SMILES	CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)OCCO)C5=CC(=C(C=C5)OCCO)OCCO)O)O)O)O)O)O
InChI	1S/C33H42O19/c1-14-23(38)26(41)28(43)32(49-14)48-13-21-24(39)27(42)29(44)33(51-21)52-31-25(40)22-17(37)11-16(45-7-4-34)12-20(22)50-30(31)15-2-3-18(46-8-5-35)19(10-15)47-9-6-36/h2-3,10-12,14,21,23-24,26-29,32-39,41-44H,4-9,13H2,1H3/t14-,21+,23-,24+,26+,27-,28+,29+,32+,33-/m0/s1
InChIKey	IYVFNTXFRYQLRP-VVSTWUKXSA-N
CAS Number	7085-55-4
ChEMBL ID	CHEMBL3182320
Herb ID	HBIN047263
Drug Bank ID	DB13124
KEGG ID	D07180
Toxicity	Organism	Test Type	Route(Dose)
	rat	LD50	intraperitoneal(165 mg/kg)
	mouse	LD50	intraperitoneal(254 mg/kg)
	rat	LD50	oral(322 mg/kg)
Structure			Download 2D MOL 3D MOL

Chineses Pinyin	ChaiHu
Use Part	Root
Habitat	HuBei, SiChuan, AnHui
Flavor	Pungent, Bitter
Meridian Tropism	Liver, Gallbladder, Lung
Species	>Kingdom: Viridiplantae 　-->Phylum: Streptophyta 　　-->Class: Equisetopsida 　　　-->Order: Apiales 　　　　-->Family: Apiaceae 　　　　　-->Genus: Bupleurum 　　　　　　-->Species: Bupleurum scorzonerifolium

Chineses Pinyin	HuaiHua
Use Part	Flower and pod
Flavor	Bitter
Meridian Tropism	Liver; Large Intestine
Species	>Kingdom: Viridiplantae 　-->Phylum: Streptophyta 　　-->Class: Equisetopsida 　　　-->Order: Fabales 　　　　-->Family: Fabaceae 　　　　　-->Genus: Styphnolobium 　　　　　　-->Species: Styphnolobium japonicum

Pair Name	Troxerutin, Fluorouracil
Partner Name	Fluorouracil
Disease Info	[ICD-11: 2B72]	Gastric cancer		Investigative
Biological Phenomena	Induction-->Apoptosis
Gene Regulation	Down-regulation	Expression	BCL2	hsa596
	Down-regulation	Expression	NFKB1	hsa4790
	Down-regulation	Expression	RELA	hsa5970
	Down-regulation	Phosphorylation	STAT3	hsa6774
In Vitro Model	SGC-7901	Human papillomavirus-related cervical adenocarcinoma	Homo sapiens (Human)	CVCL_0520
In Vitro Model	GES-1	Healthy	Homo sapiens (Human)	CVCL_EQ22
Result	Our data indicated a novel therapeutic strategy to potentiate 5-FU-induced anti-tumor effect in gastric cancer cells with resistance to 5-FU by TXN through suppression of p-STAT3/NF-κB (p65 and p50) and Bcl-2.