215dea3aa9cc26ab…

Compound
ID: 5461108480 bytesFirst seen Jun 12, 20261 collection

Fields

NameValue
cid5461108
exactMass502.96444645
hBondAcceptors17
hBondDonors3
inchiKeyZKHQWZAMYRWXGA-KQYNXXCUSA-J
iupacName[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-oxidophosphoryl]oxy-oxidophosphoryl] phosphate
molecularFormulaC10H12N5O13P3-4
molecularWeight503.15
nameATP(4-)
pubchemUrlhttps://pubchem.ncbi.nlm.nih.gov/compound/5461108
rotatableBonds7
smilesnull
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