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

Details

Stereochemistry ABSOLUTE
Molecular Formula C22H29FN3O10P
Molecular Weight 545.4519
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ADAFOSBUVIR

SMILES

CC(C)OC(=O)[C@H](C)N[P@](=O)(OC[C@@]1(F)O[C@@H](N2C=CC(=O)NC2=O)[C@](C)(O)[C@@H]1O)OC3=CC=CC=C3

InChI

InChIKey=NIJYGVDQZBBONK-SEUXLIJBSA-N
InChI=1S/C22H29FN3O10P/c1-13(2)34-17(28)14(3)25-37(32,36-15-8-6-5-7-9-15)33-12-22(23)18(29)21(4,31)19(35-22)26-11-10-16(27)24-20(26)30/h5-11,13-14,18-19,29,31H,12H2,1-4H3,(H,25,32)(H,24,27,30)/t14-,18-,19+,21+,22+,37-/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
ADAFOSBUVIR
INN   USAN  
Official Name English
AL-335
Code English
L-ALANINE, N-((P(S))-4'-C-FLUORO-2'-C-METHYL-P-PHENYL-5'-URIDYLYL)-,1-METHYLETHYL ESTER
Systematic Name English
adafosbuvir [INN]
Common Name English
PROPAN-2-YL N-((P5'S)-4'-FLUORO-2'-C-METHYL-P-O-PHENYL- 5'-URIDYLYL)-L-ALANINATE
Systematic Name English
Adafosbuvir [WHO-DD]
Common Name English
ADAFOSBUVIR [USAN]
Common Name English
JNJ-335
Code English
Code System Code Type Description
NCI_THESAURUS
C169763
Created by admin on Sat Dec 16 11:07:21 GMT 2023 , Edited by admin on Sat Dec 16 11:07:21 GMT 2023
PRIMARY
SMS_ID
300000034140
Created by admin on Sat Dec 16 11:07:21 GMT 2023 , Edited by admin on Sat Dec 16 11:07:21 GMT 2023
PRIMARY
FDA UNII
S83770Y75R
Created by admin on Sat Dec 16 11:07:21 GMT 2023 , Edited by admin on Sat Dec 16 11:07:21 GMT 2023
PRIMARY
PUBCHEM
118596336
Created by admin on Sat Dec 16 11:07:21 GMT 2023 , Edited by admin on Sat Dec 16 11:07:21 GMT 2023
PRIMARY
INN
10502
Created by admin on Sat Dec 16 11:07:21 GMT 2023 , Edited by admin on Sat Dec 16 11:07:21 GMT 2023
PRIMARY
CAS
1613589-09-5
Created by admin on Sat Dec 16 11:07:21 GMT 2023 , Edited by admin on Sat Dec 16 11:07:21 GMT 2023
PRIMARY
CAS
1929607-44-2
Created by admin on Sat Dec 16 11:07:21 GMT 2023 , Edited by admin on Sat Dec 16 11:07:21 GMT 2023
NO STRUCTURE GIVEN
DRUG BANK
DB14906
Created by admin on Sat Dec 16 11:07:21 GMT 2023 , Edited by admin on Sat Dec 16 11:07:21 GMT 2023
PRIMARY
USAN
EF-86
Created by admin on Sat Dec 16 11:07:21 GMT 2023 , Edited by admin on Sat Dec 16 11:07:21 GMT 2023
PRIMARY