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Details

Stereochemistry ABSOLUTE
Molecular Formula C34H52N10O17P2
Molecular Weight 934.7824
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TENOFOVIR DI AND MONOSOPROXIL HETERODIMER

SMILES

CC(C)OC(=O)OCOP(=O)(CO[C@]([H])(C)Cn1cnc2c(NCNc3c4c(ncn3)n(C[C@@]([H])(C)OCP(=O)(OCOC(=O)OC(C)C)OCOC(=O)OC(C)C)cn4)ncnc21)O

InChI

InChIKey=IGSVXJKHRBUXSS-JWQCQUIFSA-N
InChI=1S/C34H52N10O17P2/c1-21(2)59-32(45)51-16-56-62(48,49)19-54-24(7)9-43-14-41-26-28(37-12-39-30(26)43)35-11-36-29-27-31(40-13-38-29)44(15-42-27)10-25(8)55-20-63(50,57-17-52-33(46)60-22(3)4)58-18-53-34(47)61-23(5)6/h12-15,21-25H,9-11,16-20H2,1-8H3,(H,48,49)(H,35,37,39)(H,36,38,40)/t24-,25-/m1/s1

HIDE SMILES / InChI

Molecular Formula C34H52N10O17P2
Molecular Weight 934.7824
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Jun 26 11:12:54 UTC 2021
Edited
by admin
on Sat Jun 26 11:12:54 UTC 2021
Record UNII
F5IK9WRD50
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TENOFOVIR DI AND MONOSOPROXIL HETERODIMER
Common Name English
TENOFOVIR DISOPROXIL FUMARATE IMPURITY I
WHO-IP  
Common Name English
BIS(1-METHYLETHYL) 5-(((1R)-2-(6-((((9-((2R)-5-HYDROXY-2,11-DIMETHYL-5,9-DIOXO-3,6,8,10-TETRAOXA-5-.LAMBDA.5-PHOSPHADODECYL)-9H-PURIN-6-YL)AMINO)METHYL)AMINO)-9H-PURIN-9-YL)-1-METHYLETHOXY)METHYL)-5-OXO-2,4,6,8-TETRAOXA-5-.LAMBDA.5-PHOSPHANONANEDIOATE [W
Common Name English
(TENOFOVIR DI- AND MONOSOPROXIL HETERODIMER) [WHO-IP]
Common Name English
TENOFOVIR DISOPROXIL FUMARATE IMPURITY I [WHO-IP]
Common Name English
2,4,6,8-TETRAOXA-5-PHOSPHANONANEDIOIC ACID, 5-(((1R)-2-(6-((((9-((2R)-5-HYDROXY-2,11-DIMETHYL-5-OXIDO-9-OXO-3,6,8,10-TETRAOXA-5-PHOSPHADODEC-1-YL)-9H-PURIN-6-YL)AMINO)METHYL)AMINO)-9H-PURIN-9-YL)-1-METHYLETHOXY)METHYL)-, 1,9-BIS(1-METHYLETHYL) ESTER, 5-O
Systematic Name English
Code System Code Type Description
FDA UNII
F5IK9WRD50
Created by admin on Sat Jun 26 11:12:54 UTC 2021 , Edited by admin on Sat Jun 26 11:12:54 UTC 2021
PRIMARY
CAS
1093279-77-6
Created by admin on Sat Jun 26 11:12:54 UTC 2021 , Edited by admin on Sat Jun 26 11:12:54 UTC 2021
PRIMARY
PUBCHEM
58850802
Created by admin on Sat Jun 26 11:12:54 UTC 2021 , Edited by admin on Sat Jun 26 11:12:54 UTC 2021
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
Amount Not Specified