InterPAD - DETAILS

(2S,3S)-4-((1e)-3-((1R)-1-carboxy-2-(3,4-dihydroxyphenyl)ethoxy)-3-oxo-1-propen-1-yl)-2-(3,4-dihydroxyphenyl)-2,3-dihydro-7-hydroxy-3-benzofurancarboxylic acid 3-((1R)-1-carboxy-2-(3,4-dihydroxyphenyl)ethyl) ester, dan shen suan B, danfensuan B, lithospermic acid B, monardic acid B, salvianolic acid B

No.	Title	Href
1	Combination effects of salvianolic acid B with low-dose celecoxib on inhibition of head and neck squamous cell carcinoma growth in vitro and in vivo. Cancer Prev Res (Phila). 2010 Jun;3(6):787-96. doi: 10.1158/1940-6207.CAPR-09-0243.	`Click`

No.

Title

Href

Combination effects of salvianolic acid B with low-dose celecoxib on inhibition of head and neck squamous cell carcinoma growth in vitro and in vivo. Cancer Prev Res (Phila). 2010 Jun;3(6):787-96. doi: 10.1158/1940-6207.CAPR-09-0243.

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Name	Salvianolic acid B
PubChem CID	6451084
Molecular Weight	718.6g/mol
Synonyms	(2S,3S)-4-((1e)-3-((1R)-1-carboxy-2-(3,4-dihydroxyphenyl)ethoxy)-3-oxo-1-propen-1-yl)-2-(3,4-dihydroxyphenyl)-2,3-dihydro-7-hydroxy-3-benzofurancarboxylic acid 3-((1R)-1-carboxy-2-(3,4-dihydroxyphenyl)ethyl) ester, dan shen suan B, danfensuan B, lithospermic acid B, monardic acid B, salvianolic acid B
Formula	C₃₆H₃₀O₁₆
SMILES	C1=CC(=C(C=C1CC(C(=O)O)OC(=O)C=CC2=C3C(C(OC3=C(C=C2)O)C4=CC(=C(C=C4)O)O)C(=O)OC(CC5=CC(=C(C=C5)O)O)C(=O)O)O)O
InChI	1S/C36H30O16/c37-20-6-1-16(11-24(20)41)13-27(34(45)46)50-29(44)10-5-18-3-9-23(40)33-30(18)31(32(52-33)19-4-8-22(39)26(43)15-19)36(49)51-28(35(47)48)14-17-2-7-21(38)25(42)12-17/h1-12,15,27-28,31-32,37-43H,13-14H2,(H,45,46)(H,47,48)/b10-5+/t27-,28-,31+,32-/m1/s1
InChIKey	SNKFFCBZYFGCQN-VWUOOIFGSA-N
CAS Number	121521-90-2
ChEMBL ID	CHEMBL1615434
ChEBI ID	CHEBI:134301
Structure		Download 2D MOL 3D MOL

Chineses Pinyin	DangShen
Use Part	Root
Habitat	GanSu, SiChuan, GuiZhou
Flavor	Bitter
Meridian Tropism	Heart; Liver
Species	>Kingdom: Viridiplantae 　-->Phylum: Streptophyta 　　-->Class: Equisetopsida 　　　-->Order: Lamiales 　　　　-->Family: Lamiaceae 　　　　　-->Genus: Salvia 　　　　　　-->Species: Salvia miltiorrhiza

Pair Name	Salvianolic acid B, Celecoxib
Partner Name	Celecoxib
Disease Info	[ICD-11: 2C31.Z]	Head and neck squamous cell carcinoma		Investigative
Biological Phenomena	Induction-->Apoptosis
Gene Regulation	Down-regulation	Expression	BCL2	hsa596
	Down-regulation	Expression	COX2	hsa4513
	Down-regulation	Expression	EGFR	hsa1956
	Up-regulation	Expression	TP53	hsa7157
In Vitro Model	JHU-06	Tongue squamous cell carcinoma	Homo sapiens (Human)	CVCL_5985
	JHU-011	Laryngeal squamous cell carcinoma	Homo sapiens (Human)	CVCL_5986
	JHU-013	Hypopharyngeal squamous cell carcinoma	Homo sapiens (Human)	CVCL_5988
	JHU-022	Laryngeal squamous cell carcinoma	Homo sapiens (Human)	CVCL_5991
In Vivo Model	JHU-013 cells (2×10⁶ cells/100 μl/mouse) were injected subcutaneously into the lower backs of the mice using a 25-gauge needle in left and right sides.
Result	These results strongly suggest that combination of Sal-B, a multifunctional anticancer agent, with low-dose celecoxib holds potential as a new preventive strategy in targeting inflammatory-associated tumor development.