ERYTHRO-9-(2-HYDROXY-3-NONYL)ADENINE MONOHYDROCHLORIDE, (-)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C14H23N5O.ClH
Molecular Weight	313.826
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ERYTHRO-9-(2-HYDROXY-3-NONYL)ADENINE MONOHYDROCHLORIDE, (-)-

Structure Search

SMILES

Cl.CCCCCC[C@@H]([C@@H](C)O)N1C=NC2=C1N=CN=C2N

InChI

InChIKey=VVDXNJRUNJMYOZ-DHXVBOOMSA-N

InChI=1S/C14H23N5O.ClH/c1-3-4-5-6-7-11(10(2)20)19-9-18-12-13(15)16-8-17-14(12)19;/h8-11,20H,3-7H2,1-2H3,(H2,15,16,17);1H/t10-,11+;/m1./s1

HIDE SMILES / InChI

Molecular Formula	C14H23N5O
Molecular Weight	277.3653
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Molecular Formula	ClH
Molecular Weight	36.461
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Targets

Primary Target	Pharmacology	Condition	Potency
Adenosine deaminase 13 Target ID: CHEMBL1910 Sources: https://www.ncbi.nlm.nih.gov/pubmed/1433220	Inhibitor 8297		2.0 nM [IC50]
Phosphodiesterase 2A 7 Target ID: CHEMBL2652 Sources: https://www.ncbi.nlm.nih.gov/pubmed/16275071	Inhibitor 8297		635.0 nM [IC50]

Substance Class	Chemical Created by `admin` on `Sat Dec 16 10:54:55 GMT 2023` Edited by `admin` on `Sat Dec 16 10:54:55 GMT 2023`
Record UNII	UGQ2ATP3NK
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ERYTHRO-9-(2-HYDROXY-3-NONYL)ADENINE MONOHYDROCHLORIDE, (-)-

Common Name

English

(-)-ERYTHRO-9-(2-HYDROXY-3-NONYL)ADENINE MONOHYDROCHLORIDE

Common Name

English

9H-PURINE-9-ETHANOL, 6-AMINO-.BETA.-HEXYL-.ALPHA.-METHYL-, HYDROCHLORIDE (1:1), (.ALPHA.R,.BETA.S)-

Systematic Name

English

9H-PURINE-9-ETHANOL, 6-AMINO-.BETA.-HEXYL-.ALPHA.-METHYL-, MONOHYDROCHLORIDE, (R-(R*,S*))-

Systematic Name

English

Code System Code Type Description

CAS

81408-49-3

Created by admin on Sat Dec 16 10:54:55 GMT 2023 , Edited by admin on Sat Dec 16 10:54:55 GMT 2023

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FDA UNII

UGQ2ATP3NK

Created by admin on Sat Dec 16 10:54:55 GMT 2023 , Edited by admin on Sat Dec 16 10:54:55 GMT 2023

PRIMARY

PUBCHEM

11957547

Created by admin on Sat Dec 16 10:54:55 GMT 2023 , Edited by admin on Sat Dec 16 10:54:55 GMT 2023

PRIMARY

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ERYTHRO-9-(2-HYDROXY-3-NONYL)ADENINE MONOHYDROCHLORIDE

RACEMATE -> ENANTIOMER

Amount: