[[(2R)-1-(6-Amino-9H-purin-9-yl)propan-2-yloxy]methyl]phosphonic Acid Mono[(2R)-1-(6-amino-9H-purin-9-yl)propan-2-yl] ester

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C17H23N10O4P
Molecular Weight	462.4029
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of [[(2R)-1-(6-Amino-9H-purin-9-yl)propan-2-yloxy]methyl]phosphonic Acid Mono[(2R)-1-(6-amino-9H-purin-9-yl)propan-2-yl] ester

Structure Search

SMILES

C[C@H](CN1C=NC2=C1N=CN=C2N)OCP(O)(=O)O[C@H](C)CN3C=NC4=C(N)N=CN=C34

InChI

InChIKey=CXPWEMMTYARWDW-GHMZBOCLSA-N

InChI=1S/C17H23N10O4P/c1-10(3-26-7-24-12-14(18)20-5-22-16(12)26)30-9-32(28,29)31-11(2)4-27-8-25-13-15(19)21-6-23-17(13)27/h5-8,10-11H,3-4,9H2,1-2H3,(H,28,29)(H2,18,20,22)(H2,19,21,23)/t10-,11-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C17H23N10O4P
Molecular Weight	462.4029
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 `Wed Apr 02 19:32:44 GMT 2025` Edited by `admin` on `Wed Apr 02 19:32:44 GMT 2025`
Record UNII	TSA9K8Q44U
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

(1R)-2-(6-Amino-9H-purin-9-yl)-1-methylethyl hydrogen P-[[(1R)-2-(6-amino-9H-purin-9-yl)-1-methylethoxy]methyl]phosphonate

Preferred Name

English

[[(2R)-1-(6-Amino-9H-purin-9-yl)propan-2-yloxy]methyl]phosphonic Acid Mono[(2R)-1-(6-amino-9H-purin-9-yl)propan-2-yl] ester

Systematic Name

English

Phosphonic acid, P-[[(1R)-2-(6-amino-9H-purin-9-yl)-1-methylethoxy]methyl]-, mono[(1R)-2-(6-amino-9H-purin-9-yl)-1-methylethyl] ester

Systematic Name

English

Code System Code Type Description

PUBCHEM

163197512

Created by admin on Wed Apr 02 19:32:44 GMT 2025 , Edited by admin on Wed Apr 02 19:32:44 GMT 2025

PRIMARY

CAS

1878175-77-9

Created by admin on Wed Apr 02 19:32:44 GMT 2025 , Edited by admin on Wed Apr 02 19:32:44 GMT 2025

PRIMARY

FDA UNII

TSA9K8Q44U

Created by admin on Wed Apr 02 19:32:44 GMT 2025 , Edited by admin on Wed Apr 02 19:32:44 GMT 2025

PRIMARY