Salicylic Acid

Representations & DB's id
ChEBI:	CHEBI:16914
ChEMBL:	CHEMBL424
PubChem:	338
IUPAC:	2-hydroxybenzoic acid
Standard InChI:	InChI=1S/C7H6O3/c8-6-4-2-1-3-5(6)7(9)10/h1-4,8H,(H,9,10)
Standard InChI Key:	YGSDEFSMJLZEOE-UHFFFAOYSA-N
SMILES:	OC(=O)c1ccccc1O

Molecular propeties
AlogP:	1.09
Hydrogen bonds acceptors:	2
Hydrogen bonds donors:	2
Rotatable bonds:	1
Number of rings:	1
Molecular Weight:	138.03
Topological polar surface area:	57.5
Number of aromatic rings:	1
Fsp3:	0
Number of carbons:	7

Plant sources

Part of plant	Plant name	Ref.
Plant	Panax ginseng
Fructus	Schisandra chinensis
Plant	Rubus idaeus
Pericarpium	Citrus unshiu
Plant	Calendula officinalis
Plant	Plantago major
Plant	Artemisia cina
Flower	Crocus sativus
Germinatus	Hordeum vulgare

In vitro data

Activity Type	Activity Value	Target Name	UniProt ID
Ki	5.89E+12 nM	Serum albumin	P02768
Ki	9920 nM	Carbonic anhydrase I	P00915
Ki	7120 nM	Carbonic anhydrase II	P00918
IC50	560000 nM	Carbonic anhydrase I	P00915
IC50	680000 nM	Carbonic anhydrase II	P00918
Ki	620000 nM	Carbonic anhydrase I	P00915
Ki	740000 nM	Carbonic anhydrase II	P00918
Ki	49800 nM	Carbonic anhydrase XIV	Q9ULX7
Ki	8800 nM	Carbonic anhydrase XII	O43570
Ki	78700 nM	Carbonic anhydrase IX	Q16790
Ki	82100 nM	Carbonic anhydrase VII	P43166
Ki	11900 nM	Carbonic anhydrase VI	P23280
Ki	355000 nM	Carbonic anhydrase VB	Q9Y2D0
Ki	678000 nM	Carbonic anhydrase VA	P35218
Ki	11100 nM	Carbonic anhydrase IV	P22748
Ki	885000 nM	Carbonic anhydrase III	P07451
Ki	7100 nM	Carbonic anhydrase II	P00918
Ki	9900 nM	Carbonic anhydrase I	P00915
Potency	28183.8 nM	Lysine-specific demethylase 4D-like	B2RXH2
Potency	35481.3 nM	Survival motor neuron protein	Q16637
Potency	39810.7 nM	Aldehyde dehydrogenase 1A1	P00352
Potency	39810.7 nM	Aldehyde dehydrogenase 1A1	P00352
Potency	28183.8 nM	15-hydroxyprostaglandin dehydrogenase [NAD+]	P15428
Potency	31622.8 nM	15-hydroxyprostaglandin dehydrogenase [NAD+]	P15428
Others	12 %	Matrix metalloproteinase-2	P08253
Others	-1 %	Matrix metalloproteinase-1	P03956
Others	20 %	Arachidonate 5-lipoxygenase	P09917
Others	12 %	Matrix metalloproteinase 9	P14780
Others	14 %	Matrix metalloproteinase 8	P22894
Others	-2 %	Matrix metalloproteinase 3	P08254
Potency	11220.2 nM	Histone acetyltransferase GCN5	Q92830
Others	15.9 %	Serum albumin	P02768
Others	24.9 %	Serum albumin	P02768
Others	7 %	Serum albumin	P02768
Others	24.8 %	Serum albumin	P02768
Ki	2320000 nM	Carbonic anhydrase VI	P23280
Others	0 pm/min/mg	UDP-glucuronosyltransferase 2B10	P36537
Others	0 pm/min/mg	UDP-glucuronosyltransferase 2B4	P06133
Potency	1995.3 nM	Geminin	O75496
Others	24.77 %	Beta-glucuronidase	P08236
Others	26.48 %	Beta-glucuronidase	P08236
Others	2 %	Indoleamine 2,3-dioxygenase	P14902
IC50	66000000 nM	Ubiquitin-like domain-containing CTD phosphatase 1	Q8WVY7
IC50	1000000 nM	Bile salt export pump	O95342
Ki	78700 nM	Carbonic anhydrase IX	Q16790
Ki	7100 nM	Carbonic anhydrase II	P00918
Ki	9900 nM	Carbonic anhydrase I	P00915
IC50	500000 nM	Cyclooxygenase-1	P23219

Salicylic Acid

Representations & DB's id

Molecular propeties

Plant sources

In vitro data