U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C23H37N3O5.ClH
Molecular Weight 472.018
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3'-MYRISTOYLANCITABINE HYDROCHLORIDE

SMILES

Cl.[H][C@@]12OC3=NC(=N)C=CN3[C@]1([H])O[C@H](CO)[C@H]2OC(=O)CCCCCCCCCCCCC

InChI

InChIKey=MYIABUQNJXGQLW-WIWCRTCKSA-N
InChI=1S/C23H37N3O5.ClH/c1-2-3-4-5-6-7-8-9-10-11-12-13-19(28)30-20-17(16-27)29-22-21(20)31-23-25-18(24)14-15-26(22)23;/h14-15,17,20-22,24,27H,2-13,16H2,1H3;1H/t17-,20-,21+,22-;/m1./s1

HIDE SMILES / InChI

Approval Year

Name Type Language
3'-MYRISTOYLANCITABINE HYDROCHLORIDE
Common Name English
ANCITABINE, 3'-MYRISTOYL HYDROCHLORIDE
Common Name English
NSC-281720
Code English
TETRADECANOIC ACID, 2,3,3A,9A-TETRAHYDRO-2-(HYDROXYMETHYL)-6-IMINO-6H-FURO(2',3':4,5)OXAZOLO(3,2-A)PYRIMIDIN-3-YL ESTER, MONOHYDROCHLORIDE, (2R-(2.ALPHA.,3.BETA.,3A.BETA.,9A.BETA.))-
Systematic Name English
Code System Code Type Description
FDA UNII
0T9613W9DU
Created by admin on Fri Dec 15 15:26:23 GMT 2023 , Edited by admin on Fri Dec 15 15:26:23 GMT 2023
PRIMARY
EPA CompTox
DTXSID80330594
Created by admin on Fri Dec 15 15:26:23 GMT 2023 , Edited by admin on Fri Dec 15 15:26:23 GMT 2023
PRIMARY
NSC
281720
Created by admin on Fri Dec 15 15:26:23 GMT 2023 , Edited by admin on Fri Dec 15 15:26:23 GMT 2023
PRIMARY
CAS
53758-26-2
Created by admin on Fri Dec 15 15:26:23 GMT 2023 , Edited by admin on Fri Dec 15 15:26:23 GMT 2023
PRIMARY
PUBCHEM
90677712
Created by admin on Fri Dec 15 15:26:23 GMT 2023 , Edited by admin on Fri Dec 15 15:26:23 GMT 2023
PRIMARY