CYTIDINE 5'-MONOPHOSPHATE-N-ACETYLNEURAMINIC ACID

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C20H31N4O16P
Molecular Weight	614.4511
Optical Activity	( - )
Defined Stereocenters	10 / 10
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of CYTIDINE 5'-MONOPHOSPHATE-N-ACETYLNEURAMINIC ACID

Structure Search

SMILES

[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=TXCIAUNLDRJGJZ-BILDWYJOSA-N

InChI=1S/C20H31N4O16P/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)/t8-,9+,10+,12+,13+,14+,15+,16+,17+,20+/m0/s1

HIDE SMILES / InChI

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

Name

Type

Language

CYTIDINE 5'-MONOPHOSPHATE-N-ACETYLNEURAMINIC ACID

Systematic Name

English

N-ACETYL-.BETA.-NEURAMINIC ACID 2-(HYDROGEN 5'-CYTIDYLATE)

Systematic Name

English

(2S,4S,5S,6S)-5-ACETAMIDO-2-(((2R,3S,4S,5R)-5-(4-AZANYL-2-OXIDANYLIDENE-PYRIMIDIN-1-YL)-3,4-BIS(OXIDANYL)OXOLAN-2-YL)METHOXY-OXIDANYL-PHOSPHORYL)OXY-4-OXIDANYL-6-((1S,2S)-1,2,3-TRIS(OXIDANYL)PROPYL)OXANE-2-CARBOXYLIC ACID

Systematic Name

English

CMP-N-ACETYLNEURAMINIC ACID

Common Name

English

.BETA.-NEURAMINIC ACID, N-ACETYL-, 2-(HYDROGEN 5'-CYTIDYLATE)

Systematic Name

English

NEURAMINIC ACID, N-ACETYL-, 2-ESTER WITH 5'-CYTIDYLIC ACID

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID10904348

Created by admin on Sat Dec 16 15:35:11 GMT 2023 , Edited by admin on Sat Dec 16 15:35:11 GMT 2023

PRIMARY

FDA UNII

T8I6M8AXA0

Created by admin on Sat Dec 16 15:35:11 GMT 2023 , Edited by admin on Sat Dec 16 15:35:11 GMT 2023

PRIMARY

PUBCHEM

448209

Created by admin on Sat Dec 16 15:35:11 GMT 2023 , Edited by admin on Sat Dec 16 15:35:11 GMT 2023

PRIMARY

CAS

3063-71-6

Created by admin on Sat Dec 16 15:35:11 GMT 2023 , Edited by admin on Sat Dec 16 15:35:11 GMT 2023

PRIMARY

SALT/SOLVATE (PARENT)


					Q6AFC8JZ9W

SODIUM CYTIDINE 5'-MONOPHOSPHATE-N-ACETYLNEURAMINATE

SUBSTANCE RECORD


					T8I6M8AXA0

CYTIDINE 5'-MONOPHOSPHATE-N-ACETYLNEURAMINIC ACID