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

Details

Stereochemistry ABSOLUTE
Molecular Formula C25H43N3O6
Molecular Weight 481.6254
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CYTARABINE-5'-PALMITATE

SMILES

CCCCCCCCCCCCCCCC(=O)OC[C@H]1O[C@H]([C@@H](O)[C@@H]1O)N2C=CC(N)=NC2=O

InChI

InChIKey=SHBAKEKBTCPUFI-OUJCMCIWSA-N
InChI=1S/C25H43N3O6/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-21(29)33-18-19-22(30)23(31)24(34-19)28-17-16-20(26)27-25(28)32/h16-17,19,22-24,30-31H,2-15,18H2,1H3,(H2,26,27,32)/t19-,22-,23+,24-/m1/s1

HIDE SMILES / InChI

Molecular Formula C25H43N3O6
Molecular Weight 481.6254
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 Fri Dec 15 15:23:28 UTC 2023
Edited
by admin
on Fri Dec 15 15:23:28 UTC 2023
Record UNII
TFX122G3KD
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CYTARABINE-5'-PALMITATE
Common Name English
CYTOSINE, 1-.BETA.-D-ARABINOFURANOSYL-, 5'-PALMITATE
Systematic Name English
ARACYTIDINE 5'-PALMITATE
Common Name English
P-ARA-C
Common Name English
PALMITOYL CYTARABINE
Common Name English
ARABINOSYL CYTOSINE PALMITATE
Common Name English
NSC-135962
Code English
Code System Code Type Description
NSC
135962
Created by admin on Fri Dec 15 15:23:28 UTC 2023 , Edited by admin on Fri Dec 15 15:23:28 UTC 2023
PRIMARY
CAS
31088-06-9
Created by admin on Fri Dec 15 15:23:28 UTC 2023 , Edited by admin on Fri Dec 15 15:23:28 UTC 2023
PRIMARY
PUBCHEM
35731
Created by admin on Fri Dec 15 15:23:28 UTC 2023 , Edited by admin on Fri Dec 15 15:23:28 UTC 2023
PRIMARY
EPA CompTox
DTXSID70953190
Created by admin on Fri Dec 15 15:23:28 UTC 2023 , Edited by admin on Fri Dec 15 15:23:28 UTC 2023
PRIMARY
FDA UNII
TFX122G3KD
Created by admin on Fri Dec 15 15:23:28 UTC 2023 , Edited by admin on Fri Dec 15 15:23:28 UTC 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY