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Details

Stereochemistry ABSOLUTE
Molecular Formula C20H24N10O13P2.2C6H15N
Molecular Weight 876.7913
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2′,3′-Cyclic guanosine monophosphate-adenosine monophosphate di(triethylammonium)

SMILES

CCN(CC)CC.CCN(CC)CC.NC1=NC(=O)C2=C(N1)N(C=N2)[C@@H]3O[C@@H]4COP(O)(=O)O[C@@H]5[C@@H](COP(O)(=O)O[C@@H]3[C@@H]4O)O[C@H]([C@@H]5O)N6C=NC7=C(N)N=CN=C67

InChI

InChIKey=RWIXZRWCEQBGFN-DQNSRKNCSA-N
InChI=1S/C20H24N10O13P2.2C6H15N/c21-14-8-15(24-3-23-14)29(4-25-8)18-11(32)12-7(41-18)2-39-45(36,37)43-13-10(31)6(1-38-44(34,35)42-12)40-19(13)30-5-26-9-16(30)27-20(22)28-17(9)33;2*1-4-7(5-2)6-3/h3-7,10-13,18-19,31-32H,1-2H2,(H,34,35)(H,36,37)(H2,21,23,24)(H3,22,27,28,33);2*4-6H2,1-3H3/t6-,7-,10-,11-,12-,13-,18-,19-;;/m1../s1

HIDE SMILES / InChI

Molecular Formula C20H24N10O13P2
Molecular Weight 674.4113
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 8 / 8
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula C6H15N
Molecular Weight 101.19
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Targets

Targets

Primary TargetPharmacologyConditionPotency
Target ID: Q86WV6
Gene ID: 340061.0
Gene Symbol: TMEM173
Target Organism: Homo sapiens (Human)
3.79 nM [Kd]
Patents

Patents

Substance Class Chemical
Created
by admin
on Sat Dec 16 19:34:06 GMT 2023
Edited
by admin
on Sat Dec 16 19:34:06 GMT 2023
Record UNII
GN9MU5WU7U
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2′,3′-Cyclic guanosine monophosphate-adenosine monophosphate di(triethylammonium)
Common Name English
2′-Guanylic acid, adenylyl-(3′→5′)-, cyclic 2′→5′-nucleotide, compd. with N,N-diethylethanamine (1:2)
Systematic Name English
Code System Code Type Description
CAS
1638750-97-6
Created by admin on Sat Dec 16 19:34:06 GMT 2023 , Edited by admin on Sat Dec 16 19:34:06 GMT 2023
PRIMARY
FDA UNII
GN9MU5WU7U
Created by admin on Sat Dec 16 19:34:06 GMT 2023 , Edited by admin on Sat Dec 16 19:34:06 GMT 2023
PRIMARY
PUBCHEM
168429493
Created by admin on Sat Dec 16 19:34:06 GMT 2023 , Edited by admin on Sat Dec 16 19:34:06 GMT 2023
PRIMARY