4-AMINO-5,8-DIHYDRO-5-OXO-8-.BETA.-D-RIBOFURANOSYLPYRIDO(2,3-D)PYRIMIDINE-6-CARBOXAMIDE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C13H15N5O6
Molecular Weight	337.2881
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4-AMINO-5,8-DIHYDRO-5-OXO-8-.BETA.-D-RIBOFURANOSYLPYRIDO(2,3-D)PYRIMIDINE-6-CARBOXAMIDE

Structure Search

SMILES

NC(=O)C1=CN([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C3=C(C(N)=NC=N3)C1=O

InChI

InChIKey=SPBWHPXCWJLQRU-FITJORAGSA-N

InChI=1S/C13H15N5O6/c14-10-6-7(20)4(11(15)23)1-18(12(6)17-3-16-10)13-9(22)8(21)5(2-19)24-13/h1,3,5,8-9,13,19,21-22H,2H2,(H2,15,23)(H2,14,16,17)/t5-,8-,9-,13-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C13H15N5O6
Molecular Weight	337.2881
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Targets

Primary Target	Pharmacology	Condition	Potency
Serine/threonine-protein kinase AKT 31 Target ID: CHEMBL2111353 Sources: https://www.ncbi.nlm.nih.gov/pubmed/20068047\|https://www.ncbi.nlm.nih.gov/pubmed/22345097	Inhibitor 8504		0.8 µM [IC50]

Substance Class	Chemical Created by `admin` on `Wed Apr 02 06:44:07 GMT 2025` Edited by `admin` on `Wed Apr 02 06:44:07 GMT 2025`
Record UNII	W3UEK36Q7X
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

4-AMINO-5,8-DIHYDRO-5-OXO-8-.BETA.-D-RIBOFURANOSYLPYRIDO(2,3-D)PYRIMIDINE-6-CARBOXAMIDE

Systematic Name

English

NSC-177223

Preferred Name

English

PYRIDO(2,3-D)PYRIMIDINE-6-CARBOXAMIDE, 4-AMINO-5,8-DIHYDRO-5-OXO-8-.BETA.-D-RIBOFURANOSYL-

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID40306513