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Details

Stereochemistry ABSOLUTE
Molecular Formula C9H13F2N3O10P2
Molecular Weight 423.158
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of GEMCITABINE 5'-DIPHOSPHATE

SMILES

NC1=NC(=O)N(C=C1)[C@@H]2O[C@H](COP(O)(=O)OP(O)(O)=O)[C@@H](O)C2(F)F

InChI

InChIKey=FRQISCZGNNXEMD-QPPQHZFASA-N
InChI=1S/C9H13F2N3O10P2/c10-9(11)6(15)4(3-22-26(20,21)24-25(17,18)19)23-7(9)14-2-1-5(12)13-8(14)16/h1-2,4,6-7,15H,3H2,(H,20,21)(H2,12,13,16)(H2,17,18,19)/t4-,6-,7-/m1/s1

HIDE SMILES / InChI

Molecular Formula C9H13F2N3O10P2
Molecular Weight 423.158
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:33:16 UTC 2023
Edited
by admin
on Sat Dec 16 09:33:16 UTC 2023
Record UNII
6FIZ684IIK
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
GEMCITABINE 5'-DIPHOSPHATE
Common Name English
CYTIDINE 5'-(TRIHYDROGEN DIPHOSPHATE), 2'-DEOXY-2',2'-DIFLUORO-
Systematic Name English
2'-DEOXY-2',2'-DIFLUOROCYTIDINE 5'-(TRIHYDROGEN DIPHOSPHATE)
Common Name English
DFDCDP
Common Name English
Code System Code Type Description
FDA UNII
6FIZ684IIK
Created by admin on Sat Dec 16 09:33:16 UTC 2023 , Edited by admin on Sat Dec 16 09:33:16 UTC 2023
PRIMARY
PUBCHEM
6420157
Created by admin on Sat Dec 16 09:33:16 UTC 2023 , Edited by admin on Sat Dec 16 09:33:16 UTC 2023
PRIMARY
CAS
116371-66-5
Created by admin on Sat Dec 16 09:33:16 UTC 2023 , Edited by admin on Sat Dec 16 09:33:16 UTC 2023
PRIMARY
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