getCSID {RMassBank} | R Documentation

## Retrieve the Chemspider ID for a given compound

### Description

Given an InChIKey, this function queries the chemspider web API to retrieve the Chemspider ID of he compound with that InChIkey.

### Usage

    getCSID(query)

### Arguments

`query` | The InChIKey of the compound

### Value

Returns the chemspide

### Author(s)

Michele Stravs, Eawag <stravsmi@eawag.ch>

Erik Mueller, UFZ <erik.mueller@ufz.de>

### Examples

    ## Not run:
    # Return all CAS registry numbers stored for benzene.
    data <- getCtsRecord("UHOVQNZJYSORNB-UHFFFAOYSA-N")
    cas <- CTS.externalIdSubset(data, "CAS")

    ## End(Not run)

[Package RMassBank version 2.12.0 Index]