Dazostinag Sodium

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C21H20F2N8O10P2S2.2Na
Molecular Weight	754.485
Optical Activity	UNSPECIFIED
Defined Stereocenters	10 / 10
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[Na+].[Na+].NC1=NC=NC2=C1N=CN2[C@@H]3O[C@@H]4CO[P@]([S-])(=O)O[C@@H]5[C@H](O)[C@@H](CO[P@]([S-])(=O)O[C@H]4[C@H]3F)O[C@H]5N6C=C(F)C7=C6NC=NC7=O

InChI

InChIKey=DSMDURFDSXGNPW-NZHCJSRUSA-L

InChI=1S/C21H22F2N8O10P2S2.2Na/c22-7-1-30(17-10(7)19(33)28-5-26-17)21-15-13(32)8(38-21)2-36-42(34,44)40-14-9(3-37-43(35,45)41-15)39-20(11(14)23)31-6-29-12-16(24)25-4-27-18(12)31;;/h1,4-6,8-9,11,13-15,20-21,32H,2-3H2,(H,34,44)(H,35,45)(H2,24,25,27)(H,26,28,33);;/q;2*+1/p-2/t8-,9-,11-,13-,14-,15-,20-,21-,42-,43-;;/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	C21H20F2N8O10P2S2
Molecular Weight	708.505
Charge	-2
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	10 / 10
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 05:46:37 GMT 2025` Edited by `admin` on `Wed Apr 02 05:46:37 GMT 2025`
Record UNII	GQ7GWR7ISX
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

TAK-676 sodium

Preferred Name

English

Dazostinag Sodium

Official Name

English

DAZOSTINAG SODIUM [USAN]

Common Name

English

7-Deazainosine, [P(R)]-2?-deoxy-2?-fluoro-5?-O-[(R)-hydroxymercaptophosphinyl]-P-thioadenylyl-(3??5?)-7-fluoro-, cyclic (2??5?)-nucleotide, sodium salt (1:2)

Systematic Name

English

Dazostinag disodium

Common Name

English

TAK676 sodium

Code

English

Code System Code Type Description

NCI_THESAURUS

C173377