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Details

Stereochemistry ABSOLUTE
Molecular Formula C12H15N3O5
Molecular Weight 281.2646
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-(1-PROPYNYL)-CYTIDINE

SMILES

CC#CC1=CN([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C(=O)N=C1N

InChI

InChIKey=XXSIICQLPUAUDF-TURQNECASA-N
InChI=1S/C12H15N3O5/c1-2-3-6-4-15(12(19)14-10(6)13)11-9(18)8(17)7(5-16)20-11/h4,7-9,11,16-18H,5H2,1H3,(H2,13,14,19)/t7-,8-,9-,11-/m1/s1

HIDE SMILES / InChI

Molecular Formula C12H15N3O5
Molecular Weight 281.2646
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 Mon Mar 31 21:30:24 GMT 2025
Edited
by admin
on Mon Mar 31 21:30:24 GMT 2025
Record UNII
J7ROT2654F
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5-(1-PROPYNYL)-CYTIDINE
Systematic Name English
CYTIDINE, 5-(1-PROPYNYL)-
Preferred Name English
Code System Code Type Description
CAS
188254-40-2
Created by admin on Mon Mar 31 21:30:24 GMT 2025 , Edited by admin on Mon Mar 31 21:30:24 GMT 2025
PRIMARY
PUBCHEM
21136976
Created by admin on Mon Mar 31 21:30:24 GMT 2025 , Edited by admin on Mon Mar 31 21:30:24 GMT 2025
PRIMARY
FDA UNII
J7ROT2654F
Created by admin on Mon Mar 31 21:30:24 GMT 2025 , Edited by admin on Mon Mar 31 21:30:24 GMT 2025
PRIMARY