ADAFOSBUVIR

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 Search

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

Molecular Formula	C22H29FN3O10P
Molecular Weight	545.4519
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	6 / 6
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 11:07:21 UTC 2023` Edited by `admin` on `Sat Dec 16 11:07:21 UTC 2023`
Record UNII	S83770Y75R
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ADAFOSBUVIR

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