[3-[(2S)-2-Amino-3-methyl-butanoyl]oxy-2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]propyl] (2S)-2-amino-3-methyl-butanoate

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C19H31N7O6
Molecular Weight	453.4927
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of [3-[(2S)-2-Amino-3-methyl-butanoyl]oxy-2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]propyl] (2S)-2-amino-3-methyl-butanoate

Structure Search

SMILES

CC(C)[C@H](N)C(=O)OCC(COC(=O)[C@@H](N)C(C)C)OCN1C=NC2=C1NC(N)=NC2=O

InChI

InChIKey=GXSWPZOKTKSGEB-STQMWFEESA-N

InChI=1S/C19H31N7O6/c1-9(2)12(20)17(28)30-5-11(6-31-18(29)13(21)10(3)4)32-8-26-7-23-14-15(26)24-19(22)25-16(14)27/h7,9-13H,5-6,8,20-21H2,1-4H3,(H3,22,24,25,27)/t12-,13-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C19H31N7O6
Molecular Weight	453.4927
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 `Tue Apr 01 17:05:40 GMT 2025` Edited by `admin` on `Tue Apr 01 17:05:40 GMT 2025`
Record UNII	Q93N34KZ8N
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

L-Valine, 1,1?-[2-[(2-amino-1,6-dihydro-6-oxo-9H-purin-9-yl)methoxy]-1,3-propanediyl] ester

Preferred Name

English

[3-[(2S)-2-Amino-3-methyl-butanoyl]oxy-2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]propyl] (2S)-2-amino-3-methyl-butanoate

Common Name

English

Code System Code Type Description

FDA UNII

Q93N34KZ8N

Created by admin on Tue Apr 01 17:05:40 GMT 2025 , Edited by admin on Tue Apr 01 17:05:40 GMT 2025

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PUBCHEM

135465377

Created by admin on Tue Apr 01 17:05:40 GMT 2025 , Edited by admin on Tue Apr 01 17:05:40 GMT 2025

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CAS

130914-71-5

Created by admin on Tue Apr 01 17:05:40 GMT 2025 , Edited by admin on Tue Apr 01 17:05:40 GMT 2025

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