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

Details

Stereochemistry RACEMIC
Molecular Formula C30H55N5O3.CH4O3S
Molecular Weight 629.895
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CT-2584 MESYLATE

SMILES

CS(O)(=O)=O.CCCCCCCCCCCCNCC(O)CCCCCCCCCN1C(=O)N(C)C2=C(N(C)C=N2)C1=O

InChI

InChIKey=RCBJUJRVBGYTEO-UHFFFAOYSA-N
InChI=1S/C30H55N5O3.CH4O3S/c1-4-5-6-7-8-9-10-13-16-19-22-31-24-26(36)21-18-15-12-11-14-17-20-23-35-29(37)27-28(32-25-33(27)2)34(3)30(35)38;1-5(2,3)4/h25-26,31,36H,4-24H2,1-3H3;1H3,(H,2,3,4)

HIDE SMILES / InChI

Molecular Formula CH4O3S
Molecular Weight 96.106
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C30H55N5O3
Molecular Weight 533.7894
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

CT-2584 is a cytotoxic agent which modulates intracellular metabolism of phosphatidic acid in tumor cells. CT-2884 inhibits CTP:choline-phosphate cytidylyltransferase and causes de novo phospholipid biosynthesis via phosphatidic acid to be shunted away from phosphatidylcholine and into phosphatidylinositol. CT-2884 induced cytotoxicity is associated with disruption and swelling of endoplasmic reticulum and mitochondria. In the early 2000s, CT-2584 was investigated in phase 2 clinical trials for the treatment of prostate cancer and soft-tissue sarcoma. No development of the drug was reported since.

Approval Year

Patents

Patents

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:59:35 UTC 2023
Edited
by admin
on Fri Dec 15 15:59:35 UTC 2023
Record UNII
6YX1G1VY8K
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CT-2584 MESYLATE
Common Name English
CT-2584HMS
Common Name English
1H-PURINE-2,6-DIONE, 1-(11-(DODECYLAMINO)-10-HYDROXYUNDECYL)-3,7-DIHYDRO-3,7-DIMETHYL-, METHANESULFONATE (1:1)
Systematic Name English
CT-2584 HMS
Code English
Classification Tree Code System Code
FDA ORPHAN DRUG 124899
Created by admin on Fri Dec 15 15:59:35 UTC 2023 , Edited by admin on Fri Dec 15 15:59:35 UTC 2023
FDA ORPHAN DRUG 125899
Created by admin on Fri Dec 15 15:59:35 UTC 2023 , Edited by admin on Fri Dec 15 15:59:35 UTC 2023
FDA ORPHAN DRUG 121798
Created by admin on Fri Dec 15 15:59:35 UTC 2023 , Edited by admin on Fri Dec 15 15:59:35 UTC 2023
Code System Code Type Description
PUBCHEM
71587716
Created by admin on Fri Dec 15 15:59:35 UTC 2023 , Edited by admin on Fri Dec 15 15:59:35 UTC 2023
PRIMARY
FDA UNII
6YX1G1VY8K
Created by admin on Fri Dec 15 15:59:35 UTC 2023 , Edited by admin on Fri Dec 15 15:59:35 UTC 2023
PRIMARY
NCI_THESAURUS
C202251
Created by admin on Fri Dec 15 15:59:35 UTC 2023 , Edited by admin on Fri Dec 15 15:59:35 UTC 2023
PRIMARY
CAS
353525-62-9
Created by admin on Fri Dec 15 15:59:35 UTC 2023 , Edited by admin on Fri Dec 15 15:59:35 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY