ALS-8112 triphosphate

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C10H16ClFN3O13P3
Molecular Weight	533.619
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

NC1=NC(=O)N(C=C1)[C@@H]2O[C@](CCl)(COP(O)(=O)OP(O)(=O)OP(O)(O)=O)[C@@H](O)[C@H]2F

InChI

InChIKey=IMNKEHCKAWMCAU-IBCQBUCCSA-N

InChI=1S/C10H16ClFN3O13P3/c11-3-10(4-25-30(21,22)28-31(23,24)27-29(18,19)20)7(16)6(12)8(26-10)15-2-1-5(13)14-9(15)17/h1-2,6-8,16H,3-4H2,(H,21,22)(H,23,24)(H2,13,14,17)(H2,18,19,20)/t6-,7+,8-,10-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C10H16ClFN3O13P3
Molecular Weight	533.619
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 19:30:09 GMT 2023` Edited by `admin` on `Sat Dec 16 19:30:09 GMT 2023`
Record UNII	ZAA7YHM4C7
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ALS-8112 triphosphate

Code

English

Cytidine 5′-(tetrahydrogen triphosphate), 4′-C-(chloromethyl)-2′-deoxy-2′-fluoro-

Systematic Name

English

Code System Code Type Description

PUBCHEM

71622503

Created by admin on Sat Dec 16 19:30:10 GMT 2023 , Edited by admin on Sat Dec 16 19:30:10 GMT 2023

PRIMARY

CAS

1445383-14-1

Created by admin on Sat Dec 16 19:30:10 GMT 2023 , Edited by admin on Sat Dec 16 19:30:10 GMT 2023

PRIMARY

FDA UNII

ZAA7YHM4C7

Created by admin on Sat Dec 16 19:30:10 GMT 2023 , Edited by admin on Sat Dec 16 19:30:10 GMT 2023

PRIMARY

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