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Details

Stereochemistry ACHIRAL
Molecular Formula C23H23NO2
Molecular Weight 345.4342
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CRISNATOL

SMILES

CC(CO)(CO)NCC1=CC2=C(C=CC3=CC=CC=C23)C4=C1C=CC=C4

InChI

InChIKey=SBRXTSOCZITGQG-UHFFFAOYSA-N
InChI=1S/C23H23NO2/c1-23(14-25,15-26)24-13-17-12-22-18-7-3-2-6-16(18)10-11-21(22)20-9-5-4-8-19(17)20/h2-12,24-26H,13-15H2,1H3

HIDE SMILES / InChI

Molecular Formula C23H23NO2
Molecular Weight 345.4342
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Crisnatol is a derivative of arylmethylaminopropanediol with significant antineoplastic activity in a variety of murine and human tumor models. Crisnatol functions as a DNA intercalator, with the presence of additional basic amine groups in the sidechain enhancing binding to DNA due to electrostatic interactions. Crisnatol did not show antitumor efficacy in patients with ovarian carcinoma. In another clinical study, 2 of 26 patients with glioma showed complete long-lasting responses to the drug. The dose-limiting side effect was neurotoxicity.

Approval Year

Patents

Patents

Substance Class Chemical
Created
by admin
on Sat Dec 16 17:25:13 UTC 2023
Edited
by admin
on Sat Dec 16 17:25:13 UTC 2023
Record UNII
2J71UR51UE
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CRISNATOL
INN  
INN  
Official Name English
2-((6-CHRYSENYLMETHYL)AMINO)-2-METHYL-1,3-PROPANEDIOL
Systematic Name English
crisnatol [INN]
Common Name English
1,3-PROPANEDIOL, 2-((6-CHRYSENYLMETHYL)AMINO)-2-METHYL-
Systematic Name English
Classification Tree Code System Code
NCI_THESAURUS C582
Created by admin on Sat Dec 16 17:25:14 UTC 2023 , Edited by admin on Sat Dec 16 17:25:14 UTC 2023
Code System Code Type Description
PUBCHEM
57062
Created by admin on Sat Dec 16 17:25:14 UTC 2023 , Edited by admin on Sat Dec 16 17:25:14 UTC 2023
PRIMARY
CAS
96389-68-3
Created by admin on Sat Dec 16 17:25:14 UTC 2023 , Edited by admin on Sat Dec 16 17:25:14 UTC 2023
PRIMARY
FDA UNII
2J71UR51UE
Created by admin on Sat Dec 16 17:25:14 UTC 2023 , Edited by admin on Sat Dec 16 17:25:14 UTC 2023
PRIMARY
NCI_THESAURUS
C81191
Created by admin on Sat Dec 16 17:25:14 UTC 2023 , Edited by admin on Sat Dec 16 17:25:14 UTC 2023
PRIMARY
SMS_ID
100000083718
Created by admin on Sat Dec 16 17:25:14 UTC 2023 , Edited by admin on Sat Dec 16 17:25:14 UTC 2023
PRIMARY
ChEMBL
CHEMBL61495
Created by admin on Sat Dec 16 17:25:14 UTC 2023 , Edited by admin on Sat Dec 16 17:25:14 UTC 2023
PRIMARY
MESH
C056722
Created by admin on Sat Dec 16 17:25:14 UTC 2023 , Edited by admin on Sat Dec 16 17:25:14 UTC 2023
PRIMARY
EVMPD
SUB06820MIG
Created by admin on Sat Dec 16 17:25:14 UTC 2023 , Edited by admin on Sat Dec 16 17:25:14 UTC 2023
PRIMARY
EPA CompTox
DTXSID10242217
Created by admin on Sat Dec 16 17:25:14 UTC 2023 , Edited by admin on Sat Dec 16 17:25:14 UTC 2023
PRIMARY
WIKIPEDIA
Crisnatol
Created by admin on Sat Dec 16 17:25:14 UTC 2023 , Edited by admin on Sat Dec 16 17:25:14 UTC 2023
PRIMARY
INN
6225
Created by admin on Sat Dec 16 17:25:14 UTC 2023 , Edited by admin on Sat Dec 16 17:25:14 UTC 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT
Related Record Type Details
ACTIVE MOIETY