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Details

Stereochemistry ACHIRAL
Molecular Formula C22H34N5O8P.C4H4O4
Molecular Weight 643.58
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of BESIFOVIR DIPIVOXIL MALEATE

SMILES

OC(=O)\C=C/C(O)=O.CC(C)(C)C(=O)OCOP(=O)(COC3(CN1C=NC2=CN=C(N)N=C12)CC3)OCOC(=O)C(C)(C)C

InChI

InChIKey=DXUDWHZKSUFXKH-BTJKTKAUSA-N
InChI=1S/C22H34N5O8P.C4H4O4/c1-20(2,3)17(28)31-12-34-36(30,35-13-32-18(29)21(4,5)6)14-33-22(7-8-22)10-27-11-25-15-9-24-19(23)26-16(15)27;5-3(6)1-2-4(7)8/h9,11H,7-8,10,12-14H2,1-6H3,(H2,23,24,26);1-2H,(H,5,6)(H,7,8)/b;2-1-

HIDE SMILES / InChI
Molecular Formula C4H4O4
Molecular Weight 116.0722
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE
Molecular Formula C22H34N5O8P
Molecular Weight 527.5078
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Description

LB80380 is a prodrug of besifovir, a novel antiviral agent for the treatment of chronic hepatitis B.

Originator

Approval Year

Unknown
139594
PubMed

PubMed

TitleDatePubMed
A novel class of phosphonate nucleosides. 9-[(1-phosphonomethoxycyclopropyl)methyl]guanine as a potent and selective anti-HBV agent.
2004 May 20
Patents

Patents

20040063668
3
Substance Class Chemical
Created
by admin
on Sat Dec 16 11:07:18 GMT 2023
Edited
by admin
on Sat Dec 16 11:07:18 GMT 2023
Record UNII
MW1GD0H4VS
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BESIFOVIR DIPIVOXIL MALEATE
Common Name English
Besifovir dipivoxil maleate [WHO-DD]
Common Name English
LB80380 MALEATE SALT
Common Name English
PROPANOIC ACID, 2,2-DIMETHYL-, 1,1'-(((((1-((2-AMINO-9H-PURIN-9-YL)METHYL)CYCLOPROPYL)OXY)METHYL)PHOSPHINYLIDENE)BIS(OXYMETHYLENE)) ESTER, (2Z)-2-BUTENEDIOATE (1:1)
Common Name English
LB-80380 MALEATE SALT
Code English
Code System Code Type Description
CAS
1039623-01-2
Created by admin on Sat Dec 16 11:07:19 GMT 2023 , Edited by admin on Sat Dec 16 11:07:19 GMT 2023
PRIMARY
FDA UNII
MW1GD0H4VS
Created by admin on Sat Dec 16 11:07:19 GMT 2023 , Edited by admin on Sat Dec 16 11:07:19 GMT 2023
PRIMARY
CAS
2173240-74-7
Created by admin on Sat Dec 16 11:07:19 GMT 2023 , Edited by admin on Sat Dec 16 11:07:19 GMT 2023
NON-SPECIFIC STOICHIOMETRY
PUBCHEM
24864125
Created by admin on Sat Dec 16 11:07:19 GMT 2023 , Edited by admin on Sat Dec 16 11:07:19 GMT 2023
PRIMARY
Related Record Type Details
Structure of BESIFOVIR DIPIVOXIL
PARENT -> SALT/SOLVATE
NIH
NCATS
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