SODIUM CYTIDINE 5'-MONOPHOSPHATE-N-ACETYLNEURAMINATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C20H30N4O16P.Na
Molecular Weight	636.4329
Optical Activity	( - )
Defined Stereocenters	10 / 10
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of SODIUM CYTIDINE 5'-MONOPHOSPHATE-N-ACETYLNEURAMINATE

Structure Search

SMILES

[Na+].[H][C@]1(O[C@](C[C@H](O)[C@H]1NC(C)=O)(OP([O-])(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)N3C=CC(N)=NC3=O)C(O)=O)[C@H](O)[C@H](O)CO

InChI

InChIKey=VFRHSOGUONIUOR-HLZBELLTSA-M

InChI=1S/C20H31N4O16P.Na/c1-7(26)22-12-8(27)4-20(18(32)33,39-16(12)13(29)9(28)5-25)40-41(35,36)37-6-10-14(30)15(31)17(38-10)24-3-2-11(21)23-19(24)34;/h2-3,8-10,12-17,25,27-31H,4-6H2,1H3,(H,22,26)(H,32,33)(H,35,36)(H2,21,23,34);/q;+1/p-1/t8-,9+,10+,12+,13+,14+,15+,16+,17+,20+;/m0./s1

HIDE SMILES / InChI

Molecular Formula	C20H30N4O16P
Molecular Weight	613.4432
Charge	-1
Count

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

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

Approval Year

Targets

Primary Target	Pharmacology	Condition	Potency
Sialyltransferases 2 Target ID: Sialyltransferases Sources: https://www.ncbi.nlm.nih.gov/pubmed/8864835 \| https://www.ncbi.nlm.nih.gov/pubmed/21098518 \| https://www.caymanchem.com/product/16404	Substrate 661
Biosynthesis of sialic acid-containing complex carbohydrates 2 Target ID: Biosynthesis of sialic acid-containing complex carbohydrates Sources: https://www.scbt.com/p/cmp-sialic-acid-monosodium-salt-3063-71-6	Modulator 828

Substance Class	Chemical Created by `admin` on `Sat Dec 16 18:30:30 GMT 2023` Edited by `admin` on `Sat Dec 16 18:30:30 GMT 2023`
Record UNII	Q6AFC8JZ9W
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

SODIUM CYTIDINE 5'-MONOPHOSPHATE-N-ACETYLNEURAMINATE

Systematic Name

English

.BETA.-NEURAMINIC ACID, N-ACETYL-, 2-(HYDROGEN 5'-CYTIDYLATE), SODIUM SALT (1:1)

Systematic Name

English

N-ACETYL-.BETA.-NEURAMINIC ACID 2-(HYDROGEN 5'-CYTIDYLATE) SODIUM SALT (1:1)

Systematic Name

English

Code System Code Type Description

PUBCHEM

23680947

Created by admin on Sat Dec 16 18:30:30 GMT 2023 , Edited by admin on Sat Dec 16 18:30:30 GMT 2023

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CAS

1007117-62-5

Created by admin on Sat Dec 16 18:30:30 GMT 2023 , Edited by admin on Sat Dec 16 18:30:30 GMT 2023

PRIMARY

FDA UNII

Q6AFC8JZ9W

Created by admin on Sat Dec 16 18:30:30 GMT 2023 , Edited by admin on Sat Dec 16 18:30:30 GMT 2023

PRIMARY

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CYTIDINE 5'-MONOPHOSPHATE-N-ACETYLNEURAMINIC ACID

PARENT -> SALT/SOLVATE

Amount: