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

Details

Stereochemistry ACHIRAL
Molecular Formula C5H4N2O4.C4H11NO
Molecular Weight 245.2325
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DEANOL OROTATE

SMILES

CN(C)CCO.OC(=O)C1=CC(=O)NC(=O)N1

InChI

InChIKey=ROHGCLWGNSVXHD-UHFFFAOYSA-N
InChI=1S/C5H4N2O4.C4H11NO/c8-3-1-2(4(9)10)6-5(11)7-3;1-5(2)3-4-6/h1H,(H,9,10)(H2,6,7,8,11);6H,3-4H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C4H11NO
Molecular Weight 89.1362
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C5H4N2O4
Molecular Weight 156.0963
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 05:27:17 GMT 2023
Edited
by admin
on Sat Dec 16 05:27:17 GMT 2023
Record UNII
011841169V
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DEANOL OROTATE
WHO-DD  
Common Name English
Deanol orotate [WHO-DD]
Common Name English
4-PYRIMIDINECARBOXYLIC ACID, 1,2,3,6-TETRAHYDRO-2,6-DIOXO-, COMPD. WITH 2-(DIMETHYLAMINO)ETHANOL (1:1)
Common Name English
OROTIC ACID, COMPD. WITH 2-(DIMETHYLAMINO)ETHANOL (1:1)
Common Name English
DIMETHYLAMINOETHANOL OROTATE
Common Name English
Code System Code Type Description
CAS
1446-06-6
Created by admin on Sat Dec 16 05:27:17 GMT 2023 , Edited by admin on Sat Dec 16 05:27:17 GMT 2023
PRIMARY
SMS_ID
100000087743
Created by admin on Sat Dec 16 05:27:17 GMT 2023 , Edited by admin on Sat Dec 16 05:27:17 GMT 2023
PRIMARY
EVMPD
SUB01563MIG
Created by admin on Sat Dec 16 05:27:17 GMT 2023 , Edited by admin on Sat Dec 16 05:27:17 GMT 2023
PRIMARY
FDA UNII
011841169V
Created by admin on Sat Dec 16 05:27:17 GMT 2023 , Edited by admin on Sat Dec 16 05:27:17 GMT 2023
PRIMARY
EPA CompTox
DTXSID90162762
Created by admin on Sat Dec 16 05:27:17 GMT 2023 , Edited by admin on Sat Dec 16 05:27:17 GMT 2023
PRIMARY
PUBCHEM
6451273
Created by admin on Sat Dec 16 05:27:17 GMT 2023 , Edited by admin on Sat Dec 16 05:27:17 GMT 2023
PRIMARY