215dea3aa9cc26ab…
CompoundID:
5461108480 bytesFirst seen Jun 12, 20261 collectionFields
| Name | Value |
|---|---|
| cid | 5461108 |
| exactMass | 502.96444645 |
| hBondAcceptors | 17 |
| hBondDonors | 3 |
| inchiKey | ZKHQWZAMYRWXGA-KQYNXXCUSA-J |
| iupacName | [[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-oxidophosphoryl]oxy-oxidophosphoryl] phosphate |
| molecularFormula | C10H12N5O13P3-4 |
| molecularWeight | 503.15 |
| name | ATP(4-) |
| pubchemUrl | https://pubchem.ncbi.nlm.nih.gov/compound/5461108 |
| rotatableBonds | 7 |
| smiles | null |
| xLogP | -6 |
Canonical JSON
{
"id": "5461108",
"type": "Compound",
"data": {
"cid": 5461108,
"exactMass": 502.96444645,
"hBondAcceptors": 17,
"hBondDonors": 3,
"inchiKey": "ZKHQWZAMYRWXGA-KQYNXXCUSA-J",
"iupacName": "[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-oxidophosphoryl]oxy-oxidophosphoryl] phosphate",
"molecularFormula": "C10H12N5O13P3-4",
"molecularWeight": 503.15,
"name": "ATP(4-)",
"pubchemUrl": "https://pubchem.ncbi.nlm.nih.gov/compound/5461108",
"rotatableBonds": 7,
"smiles": null,
"xLogP": -6
}
}Appears in 1 collection
nih/pubchem-compounds1 version · Jun 12, 2026
Full hash:215dea3aa9cc26ababbe26e64fa7cdce139a684d6507764adfb6a1aaa307749e