ETHYL ADENOSINE-5'-CARBOXYLATE HYDROCHLORIDE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C12H15N5O5.ClH
Molecular Weight	345.739
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ETHYL ADENOSINE-5'-CARBOXYLATE HYDROCHLORIDE

Structure Search

SMILES

Cl.CCOC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)N2C=NC3=C2N=CN=C3N

InChI

InChIKey=ZVHKBPIFLBGJIL-RZDNRXEISA-N

InChI=1S/C12H15N5O5.ClH/c1-2-21-12(20)8-6(18)7(19)11(22-8)17-4-16-5-9(13)14-3-15-10(5)17;/h3-4,6-8,11,18-19H,2H2,1H3,(H2,13,14,15);1H/t6-,7+,8-,11+;/m0./s1

HIDE SMILES / InChI

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

Molecular Formula	C12H15N5O5
Molecular Weight	309.278
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:34:05 GMT 2023` Edited by `admin` on `Fri Dec 15 15:34:05 GMT 2023`
Record UNII	3P5WC0Z61B
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ETHYL ADENOSINE-5'-CARBOXYLATE HYDROCHLORIDE

Systematic Name

English

A-40557

Code

English

NSC-161519

Code

English

ADENOSINE-5'-ETHYL CARBOXYLATE HYDROCHLORIDE

Systematic Name

English

.BETA.-D-RIBOFURANURONIC ACID, 1-(6-AMINO-9H-PURIN-9-YL)-1-DEOXY-, ETHYL ESTER, MONOHYDROCHLORIDE

Systematic Name

English

Code System Code Type Description

NSC

161519