5-[5-(2-chloroethyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl]-2-(hydroxymethyl)oxolan-3-yl 2-(dimethoxyphosphoryl)acetate, (2R,3S,5R)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C15H22ClN2O9P
Molecular Weight	440.77
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 5-[5-(2-chloroethyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl]-2-(hydroxymethyl)oxolan-3-yl 2-(dimethoxyphosphoryl)acetate, (2R,3S,5R)-

Structure Search

SMILES

COP(=O)(CC(=O)O[C@H]1C[C@@H](O[C@@H]1CO)N2C=C(CCCl)C(=O)NC2=O)OC

InChI

InChIKey=ADNKTJWFVBALEW-QJPTWQEYSA-N

InChI=1S/C15H22ClN2O9P/c1-24-28(23,25-2)8-13(20)27-10-5-12(26-11(10)7-19)18-6-9(3-4-16)14(21)17-15(18)22/h6,10-12,19H,3-5,7-8H2,1-2H3,(H,17,21,22)/t10-,11+,12+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C15H22ClN2O9P
Molecular Weight	440.77
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	3 / 3
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 10:30:31 GMT 2023` Edited by `admin` on `Sat Dec 16 10:30:31 GMT 2023`
Record UNII	LV3E342PMH
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

5-[5-(2-chloroethyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl]-2-(hydroxymethyl)oxolan-3-yl 2-(dimethoxyphosphoryl)acetate, (2R,3S,5R)-

Systematic Name

English

Uridine, 5-(2-chloroethyl)-2′-deoxy-, 3′-[(dimethoxyphosphinyl)acetate]

Systematic Name

English

(DIMETHOXY-PHOSPHORYL)-ACETIC ACID (2R,3S,5R)-5-(5-(2-CHLORO-ETHYL)-2,4-DIOXO-3,4-DIHYDRO-2H-PYRIMIDIN-1-YL)-2-HYDROXYMETHYL-TETRAHYDRO-FURAN-3-YL ESTER

Systematic Name

English

(2R,3S,5R)-5-[5-(2-chloroethyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl]-2-(hydroxymethyl)oxolan-3-yl 2-(dimethoxyphosphoryl)acetate

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID90921699

Created by admin on Sat Dec 16 10:30:31 GMT 2023 , Edited by admin on Sat Dec 16 10:30:31 GMT 2023

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CAS

115365-38-3

Created by admin on Sat Dec 16 10:30:31 GMT 2023 , Edited by admin on Sat Dec 16 10:30:31 GMT 2023

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PUBCHEM

5272129

Created by admin on Sat Dec 16 10:30:31 GMT 2023 , Edited by admin on Sat Dec 16 10:30:31 GMT 2023

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FDA UNII

LV3E342PMH

Created by admin on Sat Dec 16 10:30:31 GMT 2023 , Edited by admin on Sat Dec 16 10:30:31 GMT 2023

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