HYDROCORTISONE HEMISUCCINATE

Search structure
Synonyms:
Status: Approved (1955)
Entry Type: Small molecule
Molecule Category: Salt Prodrug
UNII: IHV1VP592V
Parent Compound: HYDROCORTISONE

Structure
InChI Key VWQWXZAWFPZJDA-CGVGKPPMSA-N
Smile C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)CC[C@@]43C)[C@@H]1CC[C@]2(O)C(=O)COC(=O)CCC(=O)O
InChI
InChI=1S/C25H34O8/c1-23-9-7-15(26)11-14(23)3-4-16-17-8-10-25(32,24(17,2)12-18(27)22(16)23)19(28)13-33-21(31)6-5-20(29)30/h11,16-18,22,27,32H,3-10,12-13H2,1-2H3,(H,29,30)/t16-,17-,18-,22+,23-,24-,25-/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C25H36O9
Molecular Weight 480.55
AlogP 2.2
Hydrogen Bond Acceptor 7.0
Hydrogen Bond Donor 3.0
Number of Rotational Bond 6.0
Polar Surface Area 138.2
Molecular species ACID
Aromatic Rings 0.0
Heavy Atoms 33.0

Pharmacology

Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Transcription factor Nuclear receptor Nuclear hormone receptor subfamily 3 Nuclear hormone receptor subfamily 3 group C Nuclear hormone receptor subfamily 3 group C member 1
- - 190 - -
Transporter Electrochemical transporter SLC superfamily of solute carriers SLC21/SLCO family of organic anion transporting polypeptides
- - - - 102

Indications

Mesh Heading Maximum Phase Reference
Shock; Shock, Septic Phase 4 ClinicalTrials

Related Entries

Scaffolds

Parent

Cross References

Resources Reference
ChEBI 31677
ChEMBL CHEMBL977
DrugBank DB14545
DrugCentral 4456
EPA CompTox DTXSID40872905
FDA SRS IHV1VP592V
PubChem 219121
SureChEMBL SCHEMBL7664
ZINC ZINC000004097472
ChEMBL CHEMBL3989663
EPA CompTox DTXSID80894227
FDA SRS LIU00Z1Z84
PubChem 219121
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