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

Details

Stereochemistry ABSOLUTE
Molecular Formula C21H24FN6O6P
Molecular Weight 506.424
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ROVAFOVIR ETALAFENAMIDE

SMILES

CCOC(=O)[C@H](C)N[P@@](=O)(CO[C@H]1O[C@@H](N2C=NC3=C(N)N=CN=C23)C(F)=C1)OC4=CC=CC=C4

InChI

InChIKey=OCJRRXHWPBXZSU-BJBBEUPESA-N
InChI=1S/C21H24FN6O6P/c1-3-31-21(29)13(2)27-35(30,34-14-7-5-4-6-8-14)12-32-16-9-15(22)20(33-16)28-11-26-17-18(23)24-10-25-19(17)28/h4-11,13,16,20H,3,12H2,1-2H3,(H,27,30)(H2,23,24,25)/t13-,16-,20+,35+/m0/s1

HIDE SMILES / InChI

Molecular Formula C21H24FN6O6P
Molecular Weight 506.424
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

PubMed

PubMed

TitleDatePubMed
Patents
Substance Class Chemical
Created
by admin
on Sat Dec 16 11:32:31 GMT 2023
Edited
by admin
on Sat Dec 16 11:32:31 GMT 2023
Record UNII
U8S0IC8DY7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ROVAFOVIR ETALAFENAMIDE
USAN   INN  
Official Name English
ROVAFOVIR ETALAFENAMIDE [USAN]
Common Name English
GS9131
Code English
rovafovir etalafenamide [INN]
Common Name English
L-ALANINE, N-((S)-((((2R,5R)-5-(6-AMINO-9H-PURIN-9-YL)-4-FLUORO-2,5-DIHYDRO-2-FURANYL)OXY)METHYL)PHENOXYPHOSPHINYL)-, ETHYL ESTER
Systematic Name English
GS-9148 PHOSPHONOAMIDATE PRODRUG
Code English
GS-9131
Code English
Code System Code Type Description
USAN
HI-11
Created by admin on Sat Dec 16 11:32:31 GMT 2023 , Edited by admin on Sat Dec 16 11:32:31 GMT 2023
PRIMARY
FDA UNII
U8S0IC8DY7
Created by admin on Sat Dec 16 11:32:31 GMT 2023 , Edited by admin on Sat Dec 16 11:32:31 GMT 2023
PRIMARY
DRUG BANK
DB14903
Created by admin on Sat Dec 16 11:32:31 GMT 2023 , Edited by admin on Sat Dec 16 11:32:31 GMT 2023
PRIMARY
SMS_ID
100000183603
Created by admin on Sat Dec 16 11:32:31 GMT 2023 , Edited by admin on Sat Dec 16 11:32:31 GMT 2023
PRIMARY
PUBCHEM
44603336
Created by admin on Sat Dec 16 11:32:31 GMT 2023 , Edited by admin on Sat Dec 16 11:32:31 GMT 2023
PRIMARY
EPA CompTox
DTXSID301336885
Created by admin on Sat Dec 16 11:32:31 GMT 2023 , Edited by admin on Sat Dec 16 11:32:31 GMT 2023
PRIMARY
NCI_THESAURUS
C170372
Created by admin on Sat Dec 16 11:32:31 GMT 2023 , Edited by admin on Sat Dec 16 11:32:31 GMT 2023
PRIMARY
INN
10740
Created by admin on Sat Dec 16 11:32:31 GMT 2023 , Edited by admin on Sat Dec 16 11:32:31 GMT 2023
PRIMARY
CAS
912809-27-9
Created by admin on Sat Dec 16 11:32:31 GMT 2023 , Edited by admin on Sat Dec 16 11:32:31 GMT 2023
PRIMARY
WIKIPEDIA
Rovafovir etalafenamide
Created by admin on Sat Dec 16 11:32:31 GMT 2023 , Edited by admin on Sat Dec 16 11:32:31 GMT 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT
Related Record Type Details
METABOLITE ACTIVE -> PRODRUG
Related Record Type Details
ACTIVE MOIETY