Chemical Compound

Caspofungin

CAS Registry Number 162808-62-0
Caspofungin chemical structure
Primary Record

Caspofungin

In stock
3,103 g
Purity
99.6 %
CAS
162808-62-0

Compound Identifiers & Properties

CAS
162808-62-0
PubChem CID
74889167
SMILES
CCC(C)CC(C)CCCCCCCCC(=O)CC1C[C@H]([C@@H](NC(=O)[C@@H]2[C@H](CCN2C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]3C[C@H](CN3C(=O)[C@@H](NC1=O)[C@@H](C)O)O)[C@@H]([C@H](C4=CC=C(C=C4)O)O)O)[C@@H](CCN)O)O)NCCN)O
Canonical SMILES
CCC(C)CC(C)CCCCCCCCC(=O)CC1C[C@@H](O)[C@H](NCCN)NC(=O)[C@@H]2[C@@H](O)CCN2C(=O)[C@H]([C@H](O)CCN)NC(=O)[C@H]([C@H](O)[C@@H](O)c2ccc(O)cc2)NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@H]([C@@H](C)O)NC1=O

Names & Synonyms

  • Caspofungin
  • caspofungine
  • C52H88N10O15
  • B4972
  • X7253
  • C15014
  • MK-0991;L-743872
  • Z-3180
  • 162808-62-0
  • 808C620