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The downloadable file contains 2D structures for all released NSCs. The file SD file also include below compound information, and can also be downloaded individually.
- CAS Number
- PucChem SID
- SMILES Strings
- Chemical Names
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Other Compound Identifiers
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Identifier | File Size | Link | Version |
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CAS Numbers | 3.7 MB | nsc_cas.csv | March 2024 |
PubChem SID & CID | 6.9 MB | nsc_sid_cid.csv | March 2024 |
SMILES Strings | 16 MB | nsc_smiles.csv | March 2024 |
Chemical Names | 11 MB | nsc_chemcal_name.csv | March 2024 |
Old Versions
NSC_CAS_Sept2013.csv NSC to CAS number. We only have CAS number for 130,893 NSCs.
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