(8S,9S,12S,13R,14S,16R)-19-{[2-(Dimethylamino)ethyl]amino}-13-hydroxy-8,14-dimethoxy-4,10,12,16-tetramethyl-3,20,22-trioxo-2-azabicyclo[16.3.1]docosa-1(21),4,6,10,18-pentaen-9-yl carbamate hydrochlori de (1:1)

Molecular FormulaC₃₂H₄₉ClN₄O₈
Average mass653.206 Da
Monoisotopic mass652.323914 Da
ChemSpider ID8028284

- Double-bond stereo
- 6 of 6 defined stereocentres

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(8S,9S,12S,13R,14S,16R)-19-{[2-(Dimethylamino)ethyl]amino}-13-hydroxy-8,14-dimethoxy-4,10,12,16-tetramethyl-3,20,22-trioxo-2-azabicyclo[16.3.1]docosa-1(21),4,6,10,18-pentaen-9-yl carbamate hydrochlori de (1:1) [ACD/IUPAC Name]

2-Azabicyclo[16.3.1]docosa-4,6,10,18,21-pentaene-3,20,22-trione, 9-[(aminocarbonyl)oxy]-19-[[2-(dimethylamino)ethyl]amino]-13-hydroxy-8,14-dimethoxy-4,10,12,16-tetramethyl-, (8S,9S,12S,13R,14S,16R)-, hydrochloride (1:1) [ACD/Index Name]

Carbamate de (8S,9S,12S,13R,14S,16R)-19-{[2-(diméthylamino)éthyl]amino}-13-hydroxy-8,14-diméthoxy-4,10,12,16-tétraméthyl-3,20,22-trioxo-2-azabicyclo[16.3.1]docosa-1(21),4,6,10,18-pentaén-9-yle, chlorh ydrate (1:1) [French] [ACD/IUPAC Name]

17-DMAG (Alvespimycin) HCl

467214-21-7 [RN]

MFCD09026908

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

17-DMAG hydrochloride [DBID]

Experimental data
Predicted - ACD/Labs
Predicted - ChemAxon

Experimental Physico-chemical Properties
- Experimental Solubility:
  
  Soluble to 30 mM in DMSO and to 10 mM in ethanol Tocris Bioscience 2610

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

No predicted properties have been calculated for this compound.

Density:
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#H bond acceptors:
#H bond donors:
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ACD/LogP:
ACD/LogD (pH 5.5):
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ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
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Polar Surface Area:
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Click to predict properties on the Chemicalize site

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(8S,9S,12S,13R,14S,16R)-19-{[2-(Dimethylamino)ethyl]amino}-13-hydroxy-8,14-dimethoxy-4,10,12,16-tetramethyl-3,20,22-trioxo-2-azabicyclo[16.3.1]docosa-1(21),4,6,10,18-pentaen-9-yl carbamate hydrochlori de (1:1)

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Experimental Solubility:

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