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03. Biological Effects of Specific Chemicals
03. Biological Effects of Specific Chemicals
caspofungin [CHEBI:474180] (1)
05. Industrial Uses
05. Industrial Uses
caspofungin [CHEBI:474180] (1)
08. Chemical Category
08. Chemical Category
caspofungin [CHEBI:474180] (1)
caspofungin [CHEBI:474180] (1)
caspofungin [CHEBI:474180] (1)
caspofungin [CHEBI:474180] (1)
caspofungin [CHEBI:474180] (1)
caspofungin [CHEBI:474180] (1)
caspofungin [CHEBI:474180] (1)
caspofungin [CHEBI:474180] (1)
caspofungin [CHEBI:474180] (1)
caspofungin [CHEBI:474180] (1)
caspofungin [CHEBI:474180] (1)
caspofungin [CHEBI:474180] (1)
caspofungin [CHEBI:474180] (1)
caspofungin [CHEBI:474180] (1)
caspofungin [CHEBI:474180] (1)
caspofungin [CHEBI:474180] (1)
caspofungin [CHEBI:474180] (1)
caspofungin [CHEBI:474180] (1)
caspofungin [CHEBI:474180] (1)
ChEBI Compound Accession Identifier :
[CHEBI:474180]
ChEBI Compound Description :
A semisynthetic cyclic hexapeptide echinocandin antibiotic which exerts its effect by inhibiting the synthesis of 1,3-beta-D-glucan, an integral component of the fungal cell wall.
ChEBI Compound Identification Number :
474180
ChEBI InChI Value :
InChI=1S/C52H88N10O15/c1-5-28(2)24-29(3)12-10-8-6-7-9-11-13-39(69)56-34-26-38(68)46(55-22-21-54)60-50(75)43-37(67)19-23-61(43)52(77)41(36(66)18-20-53)58-49(74)42(45(71)44(70)31-14-16-32(64)17-15-31)59-48(73)35-25-33(65)27-62(35)51(76)40(30(4)63)57-47(34)72/h14-17,28-30,33-38,40-46,55,63-68,70-71H,5-13,18-27,53-54H2,1-4H3,(H,56,69)(H,57,72)(H,58,74)(H,59,73)(H,60,75)/t28?,29?,30-,33-,34+,35+,36-,37+,38-,40+,41+,42+,43+,44+,45+,46+/m1/s1
ChEBI InChIKey Value :
JYIKNQVWKBUSNH-OGZDCFRISA-N
ChEBI Compound Name :
caspofungin
ChEBI SMILES Value :
[H][C@@]1(C[C@@H](O)[C@@H](NCCN)NC(=O)[C@@H]2[C@@H](O)CCN2C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@]2([H])C[C@@H](O)CN2C(=O)[C@@H](NC1=O)[C@@H](C)O)[C@H](O)[C@@H](O)c1ccc(O)cc1)[C@H](O)CCN)NC(=O)CCCCCCCCC(C)CC(C)CC
ChEBI Substance ID :
85663384
ChEBI URL :
ChEBI:474180
ChemSpider ID :
411774
Ontomatica Chemical Accession Key (OnChAKey) :
JYIKNQVWKBUSNH_OGZDCFRISA_N_000_000000
PubChem Compound ID :
2826718