GUADECITABINE SODIUM

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C18H23N9O10P.Na
Molecular Weight	579.3931
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[Na+].NC1=NC(=O)C2=C(N1)N(C=N2)[C@H]3C[C@H](O)[C@@H](COP([O-])(=O)O[C@H]4C[C@@H](O[C@@H]4CO)N5C=NC(N)=NC5=O)O3

InChI

InChIKey=XLHBNJPXFOZFNJ-BYKQGDNKSA-M

InChI=1S/C18H24N9O10P.Na/c19-16-22-6-27(18(31)25-16)12-2-8(9(3-28)35-12)37-38(32,33)34-4-10-7(29)1-11(36-10)26-5-21-13-14(26)23-17(20)24-15(13)30;/h5-12,28-29H,1-4H2,(H,32,33)(H2,19,25,31)(H3,20,23,24,30);/q;+1/p-1/t7-,8-,9+,10+,11+,12+;/m0./s1

HIDE SMILES / InChI

Molecular Formula	Na
Molecular Weight	22.9898
Charge	1
Count

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

Molecular Formula	C18H23N9O10P
Molecular Weight	556.4033
Charge	-1
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	6 / 6
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 19:51:07 UTC 2023` Edited by `admin` on `Fri Dec 15 19:51:07 UTC 2023`
Record UNII	0RB89YH367
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

GUADECITABINE SODIUM

Official Name

English

GUANOSINE, 2'-DEOXY-5-AZACYTIDYLYL-(3'-5')-2'-DEOXY-, SODIUM SALT (1:1)

Common Name

English

GUADECITABINE SODIUM [JAN]

Common Name

English

GUADECITABINE SODIUM [USAN]

Common Name

English

S110 SODIUM SALT

Common Name

English

SGI-110 SODIUM SALT

Code

English

[(2R,3S,5R)-5-(2-Amino-6-oxo-1,6-dihydro-9H-purin-9-yl)-3-hydroxytetrahydrofuran-2-yl]methyl (2R,3S,5R)-5-(4-amino-2-oxo-1,3,5-triazin-1(2H)-yl)-2-(hydroxymethyl)tetrahydrofuran-3-yl sodium phosphate

Systematic Name

English

Guadecitabine sodium [WHO-DD]

Common Name

English

Classification Tree Code System Code

EU-Orphan Drug

EU/3/15/1597