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

Details

Stereochemistry ABSOLUTE
Molecular Formula C20H25N10O9P
Molecular Weight 580.4479
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2'-DEOXYGUANYLYL-(3'->5')-2'-DEOXYADENOSINE

SMILES

NC1=NC2=C(N=CN2[C@H]3C[C@H](OP(O)(=O)OC[C@H]4O[C@H](C[C@@H]4O)N5C=NC6=C5N=CN=C6N)[C@@H](CO)O3)C(=O)N1

InChI

InChIKey=JRABXRXRIUUBTJ-LSUSWQKBSA-N
InChI=1S/C20H25N10O9P/c21-16-14-17(24-5-23-16)29(6-25-14)12-1-8(32)11(38-12)4-36-40(34,35)39-9-2-13(37-10(9)3-31)30-7-26-15-18(30)27-20(22)28-19(15)33/h5-13,31-32H,1-4H2,(H,34,35)(H2,21,23,24)(H3,22,27,28,33)/t8-,9-,10+,11+,12+,13+/m0/s1

HIDE SMILES / InChI

Molecular Formula C20H25N10O9P
Molecular Weight 580.4479
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 6 / 6
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 13:55:42 GMT 2023
Edited
by admin
on Sat Dec 16 13:55:42 GMT 2023
Record UNII
FRO8MOI6YY
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2'-DEOXYGUANYLYL-(3'->5')-2'-DEOXYADENOSINE
Systematic Name English
ADENOSINE, 2'-DEOXYGUANYLYL-(3'->5')-2'-DEOXY-
Systematic Name English
Code System Code Type Description
PUBCHEM
135566106
Created by admin on Sat Dec 16 13:55:42 GMT 2023 , Edited by admin on Sat Dec 16 13:55:42 GMT 2023
PRIMARY
CAS
4282-64-8
Created by admin on Sat Dec 16 13:55:42 GMT 2023 , Edited by admin on Sat Dec 16 13:55:42 GMT 2023
PRIMARY
FDA UNII
FRO8MOI6YY
Created by admin on Sat Dec 16 13:55:42 GMT 2023 , Edited by admin on Sat Dec 16 13:55:42 GMT 2023
PRIMARY