(27S)-15,16,20-Trimethoxy-10,26-dimethyl-2,18-dioxa-10,26-diazaheptacyclo[27.2.2.1^3,7.1^9,13.1^19,23.0^17,35.0^27,34]hexatriaconta-1(31),3(36),4,6,13(35),14,16,19(34),20,22,29,32-dodecaen-4-ol h ydrochloride (1:1)

Molecular FormulaC₃₇H₄₁ClN₂O₆
Average mass645.184 Da
Monoisotopic mass644.265320 Da
ChemSpider ID68896394

- 1 of 2 defined stereocentres

More details:

Names and Synonyms

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

(27S)-15,16,20-Trimethoxy-10,26-dimethyl-2,18-dioxa-10,26-diazaheptacyclo[27.2.2.1^3,7.1^9,13.1^19,23.0^17,35.0^27,34]hexatriaconta-1(31),3(36),4,6,13(35),14,16,19(34),20,22,29,32-dodecaen-4-ol h ydrochloride (1:1) [ACD/IUPAC Name]

(27S)-15,16,20-Triméthoxy-10,26-diméthyl-2,18-dioxa-10,26-diazaheptacyclo[27.2.2.1^3,7.1^9,13.1^19,23.0^17,35.0^27,34]hexatriaconta-1(31),3(36),4,6,13(35),14,16,19(34),20,22,29,32-dodécaén-4-ol, chlorhydrate (1:1) [French] [ACD/IUPAC Name]

1H-15,18-Etheno-20,24-metheno-11H-[1,10]dioxacyclononadecino[13,12,11-ij:7,8,9-i'j']diisoquinolin-21-ol, 2,3,12,13,13a,14,25,25a-octahydro-5,6,8-trimethoxy-1,13-dimethyl-, (13aS)-, 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

(27S)-15,16,20-Trimethoxy-10,26-dimethyl-2,18-dioxa-10,26-diazaheptacyclo[27.2.2.1^3,7.1^9,13.1^19,23.0^17,35.0^27,34]hexatriaconta-1(31),3(36),4,6,13(35),14,16,19(34),20,22,29,32-dodecaen-4-ol h ydrochloride (1:1)

More details:

Search ChemSpider:

Search Google:

(27S)-15,16,20-Trimethoxy-10,26-dimethyl-2,18-dioxa-10,26-diazaheptacyclo[27.2.2.13,7.19,13.119,23.017,35.027,34]hexatriaconta-1(31),3(36),4,6,13(35),14,16,19(34),20,22,29,32-dodecaen-4-ol h ydrochloride (1:1)

More details:

Search ChemSpider:

Search Google:

(27S)-15,16,20-Trimethoxy-10,26-dimethyl-2,18-dioxa-10,26-diazaheptacyclo[27.2.2.1^3,7.1^9,13.1^19,23.0^17,35.0^27,34]hexatriaconta-1(31),3(36),4,6,13(35),14,16,19(34),20,22,29,32-dodecaen-4-ol h ydrochloride (1:1)