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retaspimycin hydrochloride
A hydrochloride that is the monohydrochloride salt of retaspimycin. A semi-synthetic water-soluble analogue of geldanamycin used in cancer treatment.


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05. Industrial Uses: pharmaceutical [CHEBI:52217] > drug [CHEBI:23888] > antineoplastic agent [CHEBI:35610] > retaspimycin hydrochloride [CHEBI:71956]
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05. Industrial Uses 
05. Industrial Uses
 pharmaceutical [CHEBI:52217] (1978) 
 drug [CHEBI:23888] (1930) 
 antineoplastic agent [CHEBI:35610] (760) 
 retaspimycin hydrochloride [CHEBI:71956] (1)
08. Chemical Category 
08. Chemical Category
 main group molecular entity [CHEBI:33579] (25650) 
 p-block molecular entity [CHEBI:33675] (25343) 
 halogen molecular entity [CHEBI:24471] (1475) 
 chlorine molecular entity [CHEBI:23117] (884) 
 chloride salt [CHEBI:23114] (326) 
 organic chloride salt [CHEBI:36094] (294) 
 hydrochloride [CHEBI:36807] (240) 
 retaspimycin hydrochloride [CHEBI:71956] (1)
 halide [CHEBI:37578] (1402) 
 halide salt [CHEBI:33958] (423) 
 chloride salt [CHEBI:23114] (326) 
 organic chloride salt [CHEBI:36094] (294) 
 hydrochloride [CHEBI:36807] (240) 
 retaspimycin hydrochloride [CHEBI:71956] (1)
 polyatomic entity [CHEBI:36357] (18777) 
 heteroatomic molecular entity [CHEBI:37577] (13672) 
 salt [CHEBI:24866] (931) 
 organic salt [CHEBI:24868] (775) 
 organic halide salt [CHEBI:51069] (386) 
 organic chloride salt [CHEBI:36094] (294) 
 hydrochloride [CHEBI:36807] (240) 
 retaspimycin hydrochloride [CHEBI:71956] (1)
 halide salt [CHEBI:33958] (423) 
 chloride salt [CHEBI:23114] (326) 
 organic chloride salt [CHEBI:36094] (294) 
 hydrochloride [CHEBI:36807] (240) 
 retaspimycin hydrochloride [CHEBI:71956] (1)
 halide [CHEBI:37578] (1402) 
 halide salt [CHEBI:33958] (423) 
 chloride salt [CHEBI:23114] (326) 
 organic chloride salt [CHEBI:36094] (294) 
 hydrochloride [CHEBI:36807] (240) 
 retaspimycin hydrochloride [CHEBI:71956] (1)
09. Chemical Capabilities 
09. Chemical Capabilities
 inhibitor [CHEBI:35222] (39) 
 Hsp90 inhibitor [CHEBI:63962] (9) 
 retaspimycin hydrochloride [CHEBI:71956] (1)
ChEBI Compound Accession Identifier  [CHEBI:71956]
ChEBI Compound Description  A hydrochloride that is the monohydrochloride salt of retaspimycin. A semi-synthetic water-soluble analogue of geldanamycin used in cancer treatment.
ChEBI Compound Identification Number  71956
ChEBI InChI Value  "InChI=1S/C31H45N3O8.ClH/c1-8-12-33-26-21-13-17(2)14-25(41-7)27(36)19(4)15-20(5)29(42-31(32)39)24(40-6)11-9-10-18(3)30(38)34-22(28(21)37)16-23(26)35;/h8-11,15-17,19,24-25,27,29,33,35-37H,1,12-14H2,2-7H3,(H2,32,39)(H,34,38);1H/b11-9-,18-10+,20-15+;/t17-,19+,24+,25+,27-,29+;/m1./s1"
ChEBI InChIKey Value  OIRUWDYJGMHDHJ-AFXVCOSJSA-N
ChEBI Compound Name  retaspimycin hydrochloride
ChEBI SMILES Value  Cl.CO[C@H]1C[C@H](C)Cc2c(O)c(NC(=O)\C(C)=C\C=C/[C@H](OC)[C@@H](OC(N)=O)\C(C)=C\[C@H](C)[C@H]1O)cc(O)c2NCC=C
ChEBI Substance ID  160962900
ChEBI URL  ChEBI:71956
ChemSpider ID  NS
Ontomatica Chemical Accession Key (OnChAKey)  OIRUWDYJGMHDHJ_AFXVCOSJSA_N_000_000000
PubChem Compound ID  11685945