5d06dbe39033d72f…
CompoundID:
171548440 bytesFirst seen Jun 12, 20261 collectionFields
| Name | Value |
|---|---|
| cid | 171548 |
| exactMass | 244.08816355 |
| hBondAcceptors | 4 |
| hBondDonors | 3 |
| inchiKey | YBJHBAHKTGYVGT-ZKWXMUAHSA-N |
| iupacName | 5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoic acid |
| molecularFormula | C10H16N2O3S |
| molecularWeight | 244.31 |
| name | biotin |
| pubchemUrl | https://pubchem.ncbi.nlm.nih.gov/compound/171548 |
| rotatableBonds | 5 |
| smiles | null |
| xLogP | 0.3 |
Canonical JSON
{
"id": "171548",
"type": "Compound",
"data": {
"cid": 171548,
"exactMass": 244.08816355,
"hBondAcceptors": 4,
"hBondDonors": 3,
"inchiKey": "YBJHBAHKTGYVGT-ZKWXMUAHSA-N",
"iupacName": "5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoic acid",
"molecularFormula": "C10H16N2O3S",
"molecularWeight": 244.31,
"name": "biotin",
"pubchemUrl": "https://pubchem.ncbi.nlm.nih.gov/compound/171548",
"rotatableBonds": 5,
"smiles": null,
"xLogP": 0.3
}
}Appears in 1 collection
nih/pubchem-compounds1 version · Jun 12, 2026
Full hash:5d06dbe39033d72fcd398de6e9e2bacd23d819a3fb358e475596939b691d9d31