U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C34H52O6
Molecular Weight 556.7731
Optical Activity UNSPECIFIED
Defined Stereocenters 9 / 9
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DELOXOLONE

SMILES

[H][C@@]1(CC[C@]2(C)C3=CC[C@]4([H])[C@]5([H])C[C@](C)(CC[C@]5(C)CC[C@@]4(C)[C@]3(C)CC[C@@]2([H])C1(C)C)C(O)=O)OC(=O)CCC(O)=O

InChI

InChIKey=VRFVGZRKFFTPCG-KYHPDETOSA-N
InChI=1S/C34H52O6/c1-29(2)23-12-15-34(7)24(32(23,5)14-13-25(29)40-27(37)11-10-26(35)36)9-8-21-22-20-31(4,28(38)39)17-16-30(22,3)18-19-33(21,34)6/h9,21-23,25H,8,10-20H2,1-7H3,(H,35,36)(H,38,39)/t21-,22+,23+,25+,30-,31+,32+,33-,34-/m1/s1

HIDE SMILES / InChI
Deloxolone was devoid of aldosterone-like properties. Deloxolone could be of therapeutic value in peptic ulcer diseases without inducing fluid retention, hypertension and hypokaliemia. Carbenoxolone and deloxolone were orally administered to healthy volunteers in a cross-over double-blind trial. Both the concentration in gastric juice and the output of PGE2, determined by an RIA method in basal conditions and after pentagastrin bolus, increased in drug-treated compared to vehicle-treated subjects thus supporting the hypothesis that cytoprotection might be due to gastric PGE, levels. Moreover, deloxolone induced less marked effects than carbenoxolone on body weight, hematocrit, plasma potassium and proteins, confirming that deloxolone is less similar to aldosterone than the reference drug.

Approval Year

Name Type Language
DELOXOLONE
INN  
INN  
Official Name English
deloxolone [INN]
Common Name English
3.BETA.-HYDROXYOLEAN-9(11)-EN-30-OIC ACID, HYDROGEN SUCCINATE
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C29701
Created by admin on Sat Dec 16 17:05:26 GMT 2023 , Edited by admin on Sat Dec 16 17:05:26 GMT 2023
Code System Code Type Description
CAS
68635-50-7
Created by admin on Sat Dec 16 17:05:26 GMT 2023 , Edited by admin on Sat Dec 16 17:05:26 GMT 2023
PRIMARY
SMS_ID
100000083688
Created by admin on Sat Dec 16 17:05:26 GMT 2023 , Edited by admin on Sat Dec 16 17:05:26 GMT 2023
PRIMARY
FDA UNII
I0E16819I3
Created by admin on Sat Dec 16 17:05:26 GMT 2023 , Edited by admin on Sat Dec 16 17:05:26 GMT 2023
PRIMARY
EVMPD
SUB06958MIG
Created by admin on Sat Dec 16 17:05:26 GMT 2023 , Edited by admin on Sat Dec 16 17:05:26 GMT 2023
PRIMARY
NCI_THESAURUS
C83657
Created by admin on Sat Dec 16 17:05:26 GMT 2023 , Edited by admin on Sat Dec 16 17:05:26 GMT 2023
PRIMARY
PUBCHEM
205973
Created by admin on Sat Dec 16 17:05:26 GMT 2023 , Edited by admin on Sat Dec 16 17:05:26 GMT 2023
PRIMARY
ChEMBL
CHEMBL2106405
Created by admin on Sat Dec 16 17:05:26 GMT 2023 , Edited by admin on Sat Dec 16 17:05:26 GMT 2023
PRIMARY
EPA CompTox
DTXSID101024416
Created by admin on Sat Dec 16 17:05:26 GMT 2023 , Edited by admin on Sat Dec 16 17:05:26 GMT 2023
PRIMARY
INN
5482
Created by admin on Sat Dec 16 17:05:26 GMT 2023 , Edited by admin on Sat Dec 16 17:05:26 GMT 2023
PRIMARY