Hydrocortisone

Representations & DB's id
ChEBI:	CHEBI:17650
ChEMBL:	CHEMBL389621
PubChem:	5754
IUPAC:	(8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
Standard InChI:	InChI=1S/C21H30O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h9,14-16,18,22,24,26H,3-8,10-11H2,1-2H3/t14-,15-,16-,18+,19-,20-,21-/m0/s1
Standard InChI Key:	JYGXADMDTFJGBT-VWUMJDOOSA-N
SMILES:	OCC(=O)[C@@]1(O)CC[C@@H]2[C@]1(C)C[C@H](O)[C@H]1[C@H]2CCC2=CC(=O)CC[C@]12C

Molecular propeties
AlogP:	1.78
Hydrogen bonds acceptors:	5
Hydrogen bonds donors:	3
Rotatable bonds:	2
Number of rings:	4
Molecular Weight:	362.21
Topological polar surface area:	94.8
Number of aromatic rings:	0
Fsp3:	0.81
Number of carbons:	21

Plant sources

Part of plant	Plant name	Ref.
Semen	Linum usitatissimum

Activity Type	Activity Value	Target Name	UniProt ID
Kd	630.96 nM	Testis-specific androgen-binding protein	P04278
Others	124 %	Canalicular multispecific organic anion transporter 1	Q92887
Others	10.3 %	3-keto-steroid reductase	P56937
Potency	14.1 nM	Nuclear factor NF-kappa-B p105 subunit	P19838
Potency	31622.8 nM	Endoplasmic reticulum-associated amyloid beta-peptide-binding protein	Q99714
Potency	8912.5 nM	Histone-lysine N-methyltransferase MLL	Q03164
Potency	794.3 nM	Survival motor neuron protein	Q16637
Potency	7943.3 nM	Microtubule-associated protein tau	P10636
Potency	199.5 nM	Hypoxia-inducible factor 1 alpha	Q16665
Potency	4466.8 nM	Microtubule-associated protein tau	P10636
Potency	199.5 nM	Hypoxia-inducible factor 1 alpha	Q16665
Potency	14.1 nM	Nuclear factor NF-kappa-B p105 subunit	P19838
Potency	19952.6 nM	Cytochrome P450 3A4	P08684
Potency	19952.6 nM	Cytochrome P450 3A4	P08684
Potency	65.1 nM	ATPase family AAA domain-containing protein 5	Q96QE3
Potency	73.1 nM	Nuclear factor erythroid 2-related factor 2	Q16236
Potency	29.1 nM	Nuclear factor erythroid 2-related factor 2	Q16236
Potency	163.6 nM	Nuclear factor erythroid 2-related factor 2	Q16236
Potency	9200 nM	ATPase family AAA domain-containing protein 5	Q96QE3
Potency	32629.4 nM	ATPase family AAA domain-containing protein 5	Q96QE3
Others	0 pm/min/mg	UDP-glucuronosyltransferase 2B15	P54855
Others	0 pm/min/mg	UDP-glucuronosyltransferase 2B7	P16662
Potency	20596.2 nM	Geminin	O75496
Potency	24336.5 nM	Nuclear factor erythroid 2-related factor 2	Q16236
IC50	50000 nM	Cytochrome P450 2J2	P51589