PSI-7976

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C22H29FN3O9P
Molecular Weight	529.4525
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(C)OC(=O)[C@H](C)N[P@@](=O)(OC[C@H]1O[C@@H](N2C=CC(=O)NC2=O)[C@](C)(F)[C@@H]1O)OC3=CC=CC=C3

InChI

InChIKey=TTZHDVOVKQGIBA-YBSJRAAASA-N

InChI=1S/C22H29FN3O9P/c1-13(2)33-19(29)14(3)25-36(31,35-15-8-6-5-7-9-15)32-12-16-18(28)22(4,23)20(34-16)26-11-10-17(27)24-21(26)30/h5-11,13-14,16,18,20,28H,12H2,1-4H3,(H,25,31)(H,24,27,30)/t14-,16+,18+,20+,22+,36+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C22H29FN3O9P
Molecular Weight	529.4525
Charge	0
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 `Sat Dec 16 11:30:31 GMT 2023` Edited by `admin` on `Sat Dec 16 11:30:31 GMT 2023`
Record UNII	V14CN8M621
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PSI-7976

Common Name

English

L-ALANINE, N-((P(R),2'R)-2'-DEOXY-2'-FLUORO-2'-METHYL-P-PHENYL-5'-URIDYLYL)-, 1-METHYLETHYL ESTER

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID301025684

Created by admin on Sat Dec 16 11:30:31 GMT 2023 , Edited by admin on Sat Dec 16 11:30:31 GMT 2023

PRIMARY

CAS

1190308-01-0

Created by admin on Sat Dec 16 11:30:31 GMT 2023 , Edited by admin on Sat Dec 16 11:30:31 GMT 2023

PRIMARY

PUBCHEM

45375809

Created by admin on Sat Dec 16 11:30:31 GMT 2023 , Edited by admin on Sat Dec 16 11:30:31 GMT 2023

PRIMARY

FDA UNII

V14CN8M621

Created by admin on Sat Dec 16 11:30:31 GMT 2023 , Edited by admin on Sat Dec 16 11:30:31 GMT 2023

PRIMARY

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