Compound	Quinic acid
NPACT-Id	NPACT00894
IUPAC	(3R,5R)-1,3,4,5-tetrahydroxycyclohexane-1-carboxylic acid
Synonyms	Kinic acid;
PubChem Id	6508
Class	Organic chemical
In-vitro anticancer activity	2 cancer cell lines
In-Vivo anticancer activity	No
Targets	No targets found
Properties	Physical Elemental Topological
InChi Key	AAWZDTNXLSGCEK-LNVDRNJUSA-N
InChi	1S/C7H12O6/c8-3-1-7(13,6(11)12)2-4(9)5(3)10/h3-5,8-10,13H,1-2H2,(H,11,12)/t3-,4-,5?,7?/m1/s1
SMILES	O[C@]1(C[C@@H](O)[C@H](O)[C@H](O)C1)C(=O)O
SMART	[H]OC(=O)[C@]1(O[H])C([H])([H])[C@@]([H])(O[H])[C@]([H])(O[H])[C@]([H])(O[H])C1([H])[H]
CAS No.	77-95-2
Structure Download
Cross Refrence in other databases
	Super Natural	000077952
	CTD	D011801
	HIT	-
	NCI-60 GI₅₀ data	-
Suppliers	AAA Chemistry, ABBLIS Chemicals, ABI Chem, AKos Consulting & Solutions, Ambinter, ChemExper Chemical Directory, ChemMol, Kingston Chemistry, MolPort, Sigma-Aldrich, TCI (Tokyo Chemical Industry), Vitas-M Laboratory,
Drug-Likeliness Filters	Lipinski's rule of five	Yes
	Ghose filter	No
	Veber filter	Yes
	Muegge Filter	No
Similarity Search	Human metabolite database	FDA approved drugs

NPACT

Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase