Nebularine
Properties
- Molecular formula
- C10H12N4O4
- Molar mass
- 252.23 g/mol
- Exact mass
- 252.0859 Da
- Melting point
- 181 °C
- logP
- -1.56Crippen estimate
- Polar surface area
- 113.5 Ų
- H-bond donors / acceptors
- 3 / 7
- Rotatable bonds
- 2
- Stereocentres
- R, R, R, Sin SMILES atom order
Hazards
Warning
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation100% of notifiers
Aggregated from 38 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
550-33-4SMILES
OC[C@H]1O[C@@H](n2cnc3cncnc32)[C@H](O)[C@@H]1OInChIKey
MRWXACSTFXYYMV-FDDDBJFASA-NInChI
InChI=1S/C10H12N4O4/c15-2-6-7(16)8(17)10(18-6)14-4-13-5-1-11-3-12-9(5)14/h1,3-4,6-8,10,15-17H,2H2/t6-,7-,8-,10-/m1/s1Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
11 names
- 9H-Purine, 9-β-D-ribofuranosyl-
- Purine riboside
- 9-β-D-Ribofuranosyl-9H-purine
- Ribosylpurine
- 9-β-D-Ribofuranosylpurine
- NSC 65423
- Isopurine, ribosyl-
- Purinosine
- Purine-9-β-D-ribofuranoside
- 9-β-D-Ribosyl-9H-purine
- Desaminoadenosine
Work with Nebularine
Similar compounds
Vidarabine5536-17-462 % similar
Adenosine58-61-762 % similar
Inosine58-63-962 % similar
6-Methylpurine riboside14675-48-061 % similar
6-Chloro-9-ribofuranosyl-9H-purine2004-06-061 % similar
6-Chloropurine riboside5399-87-161 % similar
N6-Methyladenosine1867-73-860 % similar
N6-Dimethyladenosine2620-62-457 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.