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Details

Stereochemistry ABSOLUTE
Molecular Formula C22H32N10O20P4
Molecular Weight 880.4395
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 7M-G-PPP-2'M-A-P MRNA CAP

SMILES

CO[C@@H]1[C@H](OP(O)(O)=O)[C@@H](COP(O)(=O)OP(O)(=O)OP([O-])(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)N3C=[N+](C)C4=C3N=C(N)NC4=O)O[C@H]1N5C=NC6=C5N=CN=C6N

InChI

InChIKey=WHPQIGRSCBTWGS-NAGRZYTCSA-N
InChI=1S/C22H32N10O20P4/c1-30-7-32(18-11(30)19(35)29-22(24)28-18)20-13(34)12(33)8(48-20)3-46-54(39,40)51-56(43,44)52-55(41,42)47-4-9-14(50-53(36,37)38)15(45-2)21(49-9)31-6-27-10-16(23)25-5-26-17(10)31/h5-9,12-15,20-21,33-34H,3-4H2,1-2H3,(H9-,23,24,25,26,28,29,35,36,37,38,39,40,41,42,43,44)/t8-,9-,12-,13-,14-,15-,20-,21-/m1/s1

HIDE SMILES / InChI

Molecular Formula C22H32N10O20P4
Molecular Weight 880.4395
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 8 / 8
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 17:36:26 GMT 2023
Edited
by admin
on Sat Dec 16 17:36:26 GMT 2023
Record UNII
P7W5ZN6FY2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
7M-G-PPP-2'M-A-P MRNA CAP
Common Name English
Guanosine 5′-(tetrahydrogen triphosphate), 7-methyl-, inner salt, P′′→5′-ester with 2′-O-methyl-3′-adenylic acid
Common Name English
7ME-GPPPA2'OME CAP
Common Name English
cap-1 (7Me-GpppA-2'OMe-3'-phosphate)
Common Name English
Adenosine 5′-(tetrahydrogen triphosphate), 2′-O-methyl-, 3′-(dihydrogen phosphate), P′′→5′-ester with 2-amino-6,9-dihydro-7-methyl-6-oxo-9-β-D-ribofuranosyl-1H-purinium inner salt
Common Name English
Code System Code Type Description
FDA UNII
P7W5ZN6FY2
Created by admin on Sat Dec 16 17:36:26 GMT 2023 , Edited by admin on Sat Dec 16 17:36:26 GMT 2023
PRIMARY
CAS
62554-22-7
Created by admin on Sat Dec 16 17:36:26 GMT 2023 , Edited by admin on Sat Dec 16 17:36:26 GMT 2023
PRIMARY
PUBCHEM
155884679
Created by admin on Sat Dec 16 17:36:26 GMT 2023 , Edited by admin on Sat Dec 16 17:36:26 GMT 2023
PRIMARY