smiles
Version:
OpenSMILES compatible parser and serializer
67 lines (66 loc) • 1.01 kB
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{
"label": "Branch",
"smiles": "CC(C)C(=O)C(C)C",
"tokens": [
{
"type": "AliphaticOrganic",
"value": "C"
},
{
"type": "AliphaticOrganic",
"value": "C"
},
{
"type": "Branch",
"value": "begin"
},
{
"type": "AliphaticOrganic",
"value": "C"
},
{
"type": "Branch",
"value": "end"
},
{
"type": "AliphaticOrganic",
"value": "C"
},
{
"type": "Branch",
"value": "begin"
},
{
"type": "Bond",
"value": "="
},
{
"type": "AliphaticOrganic",
"value": "O"
},
{
"type": "Branch",
"value": "end"
},
{
"type": "AliphaticOrganic",
"value": "C"
},
{
"type": "Branch",
"value": "begin"
},
{
"type": "AliphaticOrganic",
"value": "C"
},
{
"type": "Branch",
"value": "end"
},
{
"type": "AliphaticOrganic",
"value": "C"
}
]
}