(1S,3S)-3,5,12-Trihydroxy-3-(1-hydroxyethyl)-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydro-1-tetracenyl (3ξ)-3-amino-2,3,6-trideoxy-α-L-threo-hexopyranoside hydrochloride (1:1)

Molecular FormulaC₂₇H₃₂ClNO₁₀
Average mass565.997 Da
Monoisotopic mass565.171448 Da
ChemSpider ID107442913

- 5 of 7 defined stereocentres

More details:

Names and Synonyms

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

(1S,3S)-3,5,12-Trihydroxy-3-(1-hydroxyethyl)-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydro-1-tetracenyl (3ξ)-3-amino-2,3,6-trideoxy-α-L-threo-hexopyranoside hydrochloride (1:1) [ACD/IUPAC Name]

(1S,3S)-3,5,12-Trihydroxy-3-(1-hydroxyethyl)-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydro-1-tetracenyl-(3ξ)-3-amino-2,3,6-tridesoxy-α-L-threo-hexopyranosidhydrochlorid (1:1) [German] [ACD/IUPAC Name]

(3ξ)-3-Amino-2,3,6-tridésoxy-α-L-thréo-hexopyranoside de (1S,3S)-3,5,12-trihydroxy-3-(1-hydroxyéthyl)-10-méthoxy-6,11-dioxo-1,2,3,4,6,11-hexahydro-1-tétracényle, chlorhydrate (1:1) [French] [ACD/IUPAC Name]

5,12-Naphthacenedione, 10-[[(3ξ)-3-amino-2,3,6-trideoxy-α-L-threo-hexopyranosyl]oxy]-7,8,9,10-tetrahydro-6,8,11-trihydroxy-8-(1-hydroxyethyl)-1-methoxy-, (8S,10S)-, hydrochloride (1:1) [ACD/Index Name]

Predicted - ACD/Labs
Predicted - ChemAxon

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:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors:
#H bond donors:
#Freely Rotating Bonds:
#Rule of 5 Violations:

ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area:
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site

Patents	Personal Collections
Publication or Magazine Article	Web-based Article (blog or commentary)
Available Chemicals Databases	Biological Properties
Chemical Reactions	Chemical Safety Data
Drugs or Compounds in Development	Imaging Agents
Information Aggregators	Journal Publishers via MeSH
Ligand/binding/crystal Structure Databases	Metabolic Pathways
Molecular Libraries Screening Center Network	Natural Products
NIH Substance Repository	Physical Properties (including SAR/QSAR databases)
Protein 3D Structures	Spectroscopy Databases
Substance Vendors	Theoretical Properties
Toxicology/Environmental Databases	Virtual Library

(1S,3S)-3,5,12-Trihydroxy-3-(1-hydroxyethyl)-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydro-1-tetracenyl (3ξ)-3-amino-2,3,6-trideoxy-α-L-threo-hexopyranoside hydrochloride (1:1)

More details:

Search ChemSpider:

Search Google: