Closed maneetgoyal closed 2 years ago
@sumitnegi7
Try to prioritise finding the InChI string and InChI key for those compounds first. Feel free to split the issue between @qur786 and you to speed up the process.
@qur786 There are 345 compounds for which we have to add inchi-dictionary
I will start from the beginning of the table you can start from the end. Rest details i will share over the call tomorrow.
We will make PR's for 40-50 a batch.
We want:
export interface INCHIProps {
inchiString: string;
inchiKey: string;
molecularWeight: number;
formula: string,
CAS: string,
name: string;
}
How to figure out the InChI string and InChI key?
Make sure molecular weight and molecular formula of the chemical given in Perry and on the PubChem website match.