[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolan-2-yl]methoxy-hydroxy-phosphoryl]oxy-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-phosphinic acid (CAS 2140-58-1) — formula C16H25N5O15P2, molecular weight 589.3; category organic chemicals.
| CAS Number | 2140-58-1 |
|---|---|
| Molecular Formula | C16H25N5O15P2 |
| Molecular Weight | 589.3 |
| LogP | -6.2 |
| Category | Organic Chemicals |
[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolan-2-yl]methoxy-hydroxy-phosphoryl]oxy-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-phosphinic acid is a carbon-based organic compound with CAS registry number 2140-58-1 and molecular formula C16H25N5O15P2 (molecular weight 589.3), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 2140-58-1
Its molecular formula C16H25N5O15P2 comprises 16 C, 25 H, 5 N, 15 O, 2 P atoms.
Also known as: [[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolan-2-yl]methoxy-hydroxy-phosphoryl]oxy-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-phosphinic acid · [[(2R,3S,4R,5R)-5-(6-氨基嘌呤-9-基)-3,4-二羟基-四氢呋喃-2-基]甲氧基-羟基-磷酰基]氧基-[(2R,3R,4S,5S,6R)-3,4,5-三羟基-6-(羟甲基)氧杂环己烷-2-基]氧基次膦酸
Category: organic chemicals
The CAS registry number of [[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolan-2-yl]methoxy-hydroxy-phosphoryl]oxy-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-phosphinic acid is 2140-58-1.
Molecular formula C16H25N5O15P2, molecular weight 589.3.
It is also registered under: [[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolan-2-yl]methoxy-hydroxy-phosphoryl]oxy-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-phosphinic acid, [[(2R,3S,4R,5R)-5-(6-氨基嘌呤-9-基)-3,4-二羟基-四氢呋喃-2-基]甲氧基-羟基-磷酰基]氧基-[(2R,3R,4S,5S,6R)-3,4,5-三羟基-6-(羟甲基)氧杂环己烷-2-基]氧基次膦酸.
Category: Organic Chemicals.
Independent reference data for [[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolan-2-yl]methoxy-hydroxy-phosphoryl]oxy-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-phosphinic acid (CAS 2140-58-1), compiled from public chemistry databases.
| CAS 号 | 2140-58-1 |
|---|---|
| PubChem CID | 16500 |
| 分子式 | C16H25N5O15P2 |
| IUPAC 名称 | [[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] hydrogen phosphate |
| UNII（FDA） | NS00015209 |
| Molecular Weight | 589.3 |
|---|---|
| XLogP3 | -6.2 |
| Hydrogen Bond Donor Count | 9 |
| Hydrogen Bond Acceptor Count | 19 |
| Rotatable Bond Count | 9 |
| Exact Mass | 589.08223910 |
| Monoisotopic Mass | 589.08223910 |
| Topological Polar Surface Area | 312 |
| Heavy Atom Count | 38 |
ADP-glucose; adenosine diphosphate glucose; ADPG; 2140-58-1; Adenosine diphosphoglucose; ADP Glucose; Adenosine pyrophosphateglucose; DTXSID101318219; Adenosine 5'-(trihydrogen diphosphate), P'-alpha-D-glucopyranosyl ester; Glucose, ADP; RefChem:553025; Diphosphoglucose, Adenosine; Diphosphate Glucose, Adenosine; Glucose, Adenosine Diphosphate; Pyrophosphateglucose, Adenosine; DTXCID101748006
[[(2R,3S,4R,5R)-5-(6-氨基嘌呤-9-基)-3,4-二羟基-四氢呋喃-2-基]甲氧基-羟基-磷酰基]氧基-[(2R,3R,4S,5S,6R)-3,4,5-三羟基-6-(羟甲基)氧杂环己烷-2-基]氧基次膦酸 · CAS 2140-58-1 · C16H25N5O15P2. UNII NS00015209.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.