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Details

Stereochemistry ABSOLUTE
Molecular Formula C15H21N5O13P2
Molecular Weight 541.3005
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CYCLIC ADP-RIBOSE

SMILES

O[C@@H]1[C@H]2COP(O)(=O)OP(O)(=O)OC[C@H]3O[C@H]([C@H](O)[C@@H]3O)[N@@]4C=NC5=C(N=C[N@@]5[C@H](O2)[C@@H]1O)C4=N

InChI

InChIKey=BQOHYSXSASDCEA-KEOHHSTQSA-N
InChI=1S/C15H21N5O13P2/c16-12-7-13-18-4-19(12)14-10(23)8(21)5(31-14)1-29-34(25,26)33-35(27,28)30-2-6-9(22)11(24)15(32-6)20(13)3-17-7/h3-6,8-11,14-16,21-24H,1-2H2,(H,25,26)(H,27,28)/t5-,6-,8-,9-,10-,11-,14-,15-/m1/s1

HIDE SMILES / InChI

Molecular Formula C15H21N5O13P2
Molecular Weight 541.3005
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 11:21:47 GMT 2023
Edited
by admin
on Sat Dec 16 11:21:47 GMT 2023
Record UNII
Q780BR06V8
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CYCLIC ADP-RIBOSE
Common Name English
ADENOSINE 5'-(TRIHYDROGEN DIPHOSPHATE), N-ALPHA-D-RIBOFURANOSYL-, INTRAMOL. 5'-5'-ESTER
Common Name English
CAPD RIBOSE
Common Name English
ADENOSINE 5'-(TRIHYDROGEN DIPHOSPHATE), N-.ALPHA.-D-RIBOFURANOSYL-, INTRAMOL. 5'-5'-ESTER
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID50896995
Created by admin on Sat Dec 16 11:21:48 GMT 2023 , Edited by admin on Sat Dec 16 11:21:48 GMT 2023
PRIMARY
PUBCHEM
123847
Created by admin on Sat Dec 16 11:21:48 GMT 2023 , Edited by admin on Sat Dec 16 11:21:48 GMT 2023
PRIMARY
CAS
119340-53-3
Created by admin on Sat Dec 16 11:21:47 GMT 2023 , Edited by admin on Sat Dec 16 11:21:47 GMT 2023
PRIMARY
WIKIPEDIA
Cyclic ADP-ribose
Created by admin on Sat Dec 16 11:21:48 GMT 2023 , Edited by admin on Sat Dec 16 11:21:48 GMT 2023
PRIMARY
CHEBI
73672
Created by admin on Sat Dec 16 11:21:47 GMT 2023 , Edited by admin on Sat Dec 16 11:21:47 GMT 2023
PRIMARY
FDA UNII
Q780BR06V8
Created by admin on Sat Dec 16 11:21:48 GMT 2023 , Edited by admin on Sat Dec 16 11:21:48 GMT 2023
PRIMARY