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Details

Stereochemistry EPIMERIC
Molecular Formula C10H17N2O13P3S
Molecular Weight 498.234
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of THYMIDINE 5'-O-(1-THIOTRIPHOSPHATE)

SMILES

CC1=CN([C@H]2C[C@H](O)[C@@H](COP(S)(=O)OP(O)(=O)OP(O)(O)=O)O2)C(=O)NC1=O

InChI

InChIKey=PXHHTOSRELKWOE-MXWQNOQOSA-N
InChI=1S/C10H17N2O13P3S/c1-5-3-12(10(15)11-9(5)14)8-2-6(13)7(23-8)4-22-28(21,29)25-27(19,20)24-26(16,17)18/h3,6-8,13H,2,4H2,1H3,(H,19,20)(H,21,29)(H,11,14,15)(H2,16,17,18)/t6-,7+,8+,28?/m0/s1

HIDE SMILES / InChI

Molecular Formula C10H17N2O13P3S
Molecular Weight 498.234
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 16:32:35 GMT 2023
Edited
by admin
on Sat Dec 16 16:32:35 GMT 2023
Record UNII
IMD4Y6027Y
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
THYMIDINE 5'-O-(1-THIOTRIPHOSPHATE)
Common Name English
THYMIDINE, 5'->P''-ESTER WITH THIOTRIPHOSPHORIC ACID ((HO)2P(O)OP(O)(OH)OP(O)(OH)(SH))
Systematic Name English
THIOTRIPHOSPHORIC ACID ((HO)2P(O)O(O)(O)P(OH)OP(S)(OH)2), 5'-MONOESTER WITH THYMIDINE
Systematic Name English
Code System Code Type Description
CAS
18883-94-8
Created by admin on Sat Dec 16 16:32:35 GMT 2023 , Edited by admin on Sat Dec 16 16:32:35 GMT 2023
PRIMARY
PUBCHEM
161258
Created by admin on Sat Dec 16 16:32:35 GMT 2023 , Edited by admin on Sat Dec 16 16:32:35 GMT 2023
PRIMARY
FDA UNII
IMD4Y6027Y
Created by admin on Sat Dec 16 16:32:35 GMT 2023 , Edited by admin on Sat Dec 16 16:32:35 GMT 2023
PRIMARY