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Acadesine

PubChem CID: 17513

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Compound Synonyms ACADESINE, 2627-69-2, AICAR, AICA-riboside, Arasine, AICA riboside, AIC-Riboside, Acadesina, Acadesinum, Protara, GP-1-110, Acadesinum [INN-Latin], Acadesina [INN-Spanish], 5-Amino-1-beta-D-ribofuranosyl-1H-imidazole-4-carboxamide, 5-Amino-1-beta-D-ribofuranosylimidazole-4-carboxamide, Acadesine [USAN:INN:BAN], 5-Aminoimidazole-4-carboxamide riboside, AICAR (Acadesine), DTXSID5046015, GP 1-110, CHEBI:28498, 5-Amino-1-beta-D-ribofuranosyl-4-imidazolecarboxamide, 5-Amino-4-imidazolecarboxamide ribofuranoside, 5-Aminoimidazole-4-carboxamide ribonucleoside, ACADESINE [INN], ACADESINE [MI], ACADESINE [USAN], EINECS 220-097-5, MFCD00869751, ACADESINE [MART.], 53IEF47846, NSC 105823, NSC-105823, SCH-900395, ACADESINE [WHO-DD], 5-Amino-1-beta-ribofuranosyl-imidazole-4-carboxamide, 5-Amino-1beta-D-ribofuranosylimidazole-4-carboxyamide, 5-aminoimidazole-4-carboxamide-1-beta-D-ribofuranoside, DTXCID3026015, EC Number 220-097-5, 5-amino-1-(beta-D-ribofuranosyl)-1H-imidazole-4-carboxamide, 1H-Imidazole-4-carboxamide, 5-amino-1-.beta.-D-ribofuranosyl-, Z-Riboside, NSC105823, 5-Amino-1-.beta.-D-ribofuranosylimidazole-4-carboxamide, Imidazole-4-carboxamide, 5-amino-1-beta-D-ribofuranosyl-, 1H-Imidazole-4-carboxamide, 5-amino-1-beta-D-ribofuranosyl-, Acadesinum (INN-Latin), Acadesina (INN-Spanish), ACADESINE (MART.), 5-amino-1-ribofuranosylimidazole-4-carboxamide, 5-amino-1-((2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)-1H-imidazole-4-carboxamide, 5-Amino-1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1H-imidazole-4-carboxamide, 5-AMINO-1-B-D-RIBOFURANOSYLIMIDAZOLE-4-CARBOXAMIDE, N(1)-(beta-D-ribofuranosyl)-5-aminoimidazole-4-carboxamide, Acadra, 5-AMINOIMIDAZOLE-4-CARBOXAMIDE-1-.BETA.-D-RIBOFURANOSIDE, C9H14N4O5, GP 1 110, SMR003435998, AICA ribofuranoside, AICA ribonucleoside, CAS-2627-69-2, aminoimidazole carboxamide ribonucleoside, ARA100, UNII-53IEF47846, 5-Aminoimidazole-4-carboxamide-1-beta-riboside, ARA 100, ARA-100, ATH-001, 5-amino-1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]imidazole-4-carboxamide, NCGC00096051-02, 5-amino-1-((2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl)-1H-imidazole-4-carboxamide, AICAR (Standard), Acadesine (AICAR), AICAR (Acadesine)?, 1-ribosyl-4-carboxamido-5-aminoimidazole, ath001, Acadesine (USAN/INN), 5-aminoimidazole-4-carboxamide 1-ribofuranoside, 5-Amino-1-.beta.-D-ribofuranosyl-1H-imidazole-4-carboxamide, MLS004774120, MLS006010069, SCHEMBL219336, GTPL5133, CHEMBL1551724, C01EB13, AICA-riboside, LC-tDDA, CE40, EX-A7096, Tox21_111551, HB2152, HSCI1_000213, HY-13417R, NSC811018, s1802, AICAR, >=98% (HPLC), powder, AKOS016004462, Tox21_111551_1, CCG-267038, CS-1951, DB04944, NA03552, NSC-811018, 5-Amino-4-imidazolecarboxamide Riboside, SRI-4077-02, SRI-4077_04, NCGC00165736-01, NCGC00165736-03, NCGC00165736-04, NCGC00165736-16, 5-amino-1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]imidazole-4-carboxamide, AC-26840, AS-13787, HY-13417, GP-1-110-0, NS00014782, C04663, D02742, 5-Aminoimidazole-4-carboxamide-1-b-D-ribofuranose, 5-Amino-1-beta-ribofuranosylimidazole-4-carboxamide, 5-Aminoimidazole-4-carboxamide-1-?-D-ribofuranoside, Q4671562, BRD-K53448858-001-07-0, 5-Aminoimidazole-4-carboxamide 1-(1/4)?-D-ribofuranoside, N1-(beta-D-Ribofuranosyl)-5-aminoimidaz ole-4-carboxamide, N1-(beta-D-Ribofuranosyl)-5-aminoimidazole-4-carboxamide, Acadesine, N1-(b-D-Ribofuranosyl)-5-aminoimidazole-4-carboxamide, AICAR, AICA-Riboside
Topological Polar Surface Area 157.0
Hydrogen Bond Donor Count 5.0
Heavy Atom Count 18.0
Isotope Atom Count 0.0
Molecular Complexity 330.0
Database Name cmaup_ingredients;hmdb_chem_all;npass_chem_all;pubchem
Defined Atom Stereocenter Count 4.0
Uniprot Id n.a., P49841, P0DTD1
Iupac Name 5-amino-1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]imidazole-4-carboxamide
Prediction Hob 0.0
Class Imidazole ribonucleosides and ribonucleotides
Xlogp -2.2
Superclass Nucleosides, nucleotides, and analogues
Molecular Formula C9H14N4O5
Prediction Swissadme 0.0
Inchi Key RTRQQBHATOEIAF-UUOKFMHZSA-N
Fcsp3 0.5555555555555556
Logs -1.451
Rotatable Bond Count 3.0
Logd -0.949
Synonyms 5-Amino-1-beta-D-ribofuranosyl-4-imidazolecarboxamide, 5-Amino-1-beta-D-ribofuranosylimidazole-4-carboxamide, 5-Amino-1-beta-ribofuranosyl-imidazole-4-carboxamide, 5-Amino-1-ribofuranosylimidazole-4-carboxamide, 5-Amino-1beta-D-ribofuranosylimidazole-4-carboxyamide, 5-Amino-4-imidazolecarboxamide ribofuranoside, 5-Aminoimidazole-4-carboxamide ribonucleoside, Acadesina, Acadesinum, AIC-riboside, AICAr, EC number 220-097-5, GP 1-110, GP-1-110, N(1)-(beta-D-Ribofuranosyl)-5-aminoimidazole-4-carboxamide, 5-Amino-1-b-D-ribofuranosyl-4-imidazolecarboxamide, 5-Amino-1-β-D-ribofuranosyl-4-imidazolecarboxamide, 5-Amino-1-b-D-ribofuranosylimidazole-4-carboxamide, 5-Amino-1-β-D-ribofuranosylimidazole-4-carboxamide, 5-Amino-1-b-ribofuranosyl-imidazole-4-carboxamide, 5-Amino-1-β-ribofuranosyl-imidazole-4-carboxamide, 5-Amino-1b-D-ribofuranosylimidazole-4-carboxyamide, 5-Amino-1β-D-ribofuranosylimidazole-4-carboxyamide, N(1)-(b-D-Ribofuranosyl)-5-aminoimidazole-4-carboxamide, N(1)-(Β-D-ribofuranosyl)-5-aminoimidazole-4-carboxamide, AICA Ribonucleoside, Z-Riboside, Arasine, AICA Riboside, ARA-100, Aminoimidazole carboxamide ribonucleoside, 5-Aminoimidazole-4-carboxamide riboside, AICA Ribofuranoside, 1-Ribosyl-4-carboxamido-5-aminoimidazole, 5-Aminoimidazole-4-carboxamide 1-ribofuranoside, ARA 100, 5-Amino-1-β-D-ribofuranosyl-imidazole-4-carboxamide, 5-Amino-1-beta-D-ribofuranosyl-imidazole-4-carboxamide, 5-Amino-1-β-D-ribofuranosyl-1H-imidazole-4-carboxamide, 5-Amino-1-beta-D-ribofuranosyl-1H-imidazole-4-carboxamide, 1-Β-D-ribofuranosyl-5-amino-4-imidazolecarboxamide, 1-beta-D-Ribofuranosyl-5-amino-4-imidazolecarboxamide, 5-Amino-1-ribosyl-4-imidazolecarboxamide, 5-Amino-4-imidazolecarboxamide riboside, 5-Aminoimidazole-4-carboxamide 1-(β-D-ribofuranoside), 5-Aminoimidazole-4-carboxamide 1-(beta-D-ribofuranoside), Acadesine, Acadra, NSC 105823, 5-Aminoimidazole-4-carboxamide-N-ribofuranoside, AICA-riboside
Compound Name Acadesine
Kingdom Organic compounds
Prediction Hob Swissadme 0.0
Exact Mass 258.096
Formal Charge 0.0
Monoisotopic Mass 258.096
Hydrogen Bond Acceptor Count 7.0
Molecular Weight 258.23
Covalent Unit Count 1.0
Total Atom Stereocenter Count 4.0
Total Bond Stereocenter Count 0.0
Molecular Framework Aromatic heteromonocyclic compounds
Esol -0.5414063555555555
Inchi InChI=1S/C9H14N4O5/c10-7-4(8(11)17)12-2-13(7)9-6(16)5(15)3(1-14)18-9/h2-3,5-6,9,14-16H,1,10H2,(H2,11,17)/t3-,5-,6-,9-/m1/s1
Smiles C1=NC(=C(N1[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O)N)C(=O)N
Nring 2.0
Defined Bond Stereocenter Count 0.0
Taxonomy Direct Parent Imidazole ribonucleosides and ribonucleotides

  • 1. Outgoing r'ship FOUND_IN to/from Iris Sanguinea (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
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