2′-Adenylic acid, 5′-(dihydrogen phosphate), 5′-anhydride with sulfuric acid
CAS Registry Number®
62230-89-1
CAS Name
2′-Adenylic acid, 5′-(dihydrogen phosphate), 5′-anhydride with sulfuric acidMolecular Formula
C10H15N5O13P2SMolecular Mass
507.26Cite this Page
2′-Adenylic acid, 5′-(dihydrogen phosphate), 5′-anhydride with sulfuric acid. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=62230-89-1 (retrieved ) (CAS RN: 62230-89-1). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C10H15N5O13P2S/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(27-29(17,18)19)6(16)4(26-10)1-25-30(20,21)28-31(22,23)24/h2-4,6-7,10,16H,1H2,(H,20,21)(H2,11,12,13)(H2,17,18,19)(H,22,23,24)/t4-,6-,7-,10-/m1/s1
InChIKey
InChIKey=SGNZKKOMSOPYFR-KQYNXXCUSA-N
SMILES
O(P(=O)(O)O)[C@H]1[C@@H](O[C@H](COP(OS(=O)(=O)O)(=O)O)[C@H]1O)N2C=3C(N=C2)=C(N)N=CN3
Canonical SMILES
O=P(O)(O)OC1C(O)C(OC1N2C=NC=3C(=NC=NC32)N)COP(=O)(O)OS(=O)(=O)O
Other Names for this Substance
- 2′-Adenylic acid, 5′-(dihydrogen phosphate), 5′-anhydride with sulfuric acid
- 2′-Phosphoadenosine 5′-phosphosulfate
- IsoPAPS
- Adenosine 2′-phosphate 5′-phosphosulfate
- iso-PAPS
