LY-309887 Disodium salt

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C19H21N5O6S.2Na
Molecular Weight	493.444
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[Na+].[Na+].NC1=NC2=C(C[C@@H](CCC3=CC=C(S3)C(=O)N[C@@H](CCC([O-])=O)C([O-])=O)CN2)C(=O)N1

InChI

InChIKey=BXKCWYLFNQBKHH-QVJGMPPOSA-L

InChI=1S/C19H23N5O6S.2Na/c20-19-23-15-11(16(27)24-19)7-9(8-21-15)1-2-10-3-5-13(31-10)17(28)22-12(18(29)30)4-6-14(25)26;;/h3,5,9,12H,1-2,4,6-8H2,(H,22,28)(H,25,26)(H,29,30)(H4,20,21,23,24,27);;/q;2*+1/p-2/t9-,12+;;/m1../s1

HIDE SMILES / InChI

Molecular Formula	Na
Molecular Weight	22.98976928
Charge	1
Count

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

Molecular Formula	C19H21N5O6S
Molecular Weight	447.465
Charge	-2
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 `Mon Mar 31 18:03:48 GMT 2025` Edited by `admin` on `Mon Mar 31 18:03:48 GMT 2025`
Record UNII	EI159U62ER
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

LY-309887 Disodium salt

Code

English

LY309887 Disodium salt

Preferred Name

English

DISODIUM N-((5-(2-((6R)-2-AMINO-3,4,5,6,7,8-HEXAHYDRO-4-OXOPYRIDO(2,3-D)PYRIMIDIN-6-YL)ETHYL)-2-THIENYL)CARBONYL)-L-GLUTAMATE

Systematic Name

English

Code System Code Type Description

FDA UNII

EI159U62ER

Created by admin on Mon Mar 31 18:03:48 GMT 2025 , Edited by admin on Mon Mar 31 18:03:48 GMT 2025

PRIMARY

PUBCHEM

135565850

Created by admin on Mon Mar 31 18:03:48 GMT 2025 , Edited by admin on Mon Mar 31 18:03:48 GMT 2025

PRIMARY

Related Record Type Details


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LY-309887

PARENT -> SALT/SOLVATE

Amount: